Organoheterocyclic compounds
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1H-Tetrazole, 0.45M in acetonitrile
CAS: 288-94-8 Molecular Formula: CH2N4 Molecular Weight (g/mol): 70.055 MDL Number: MFCD00005247 InChI Key: KJUGUADJHNHALS-UHFFFAOYSA-N PubChem CID: 67519 ChEBI: CHEBI:33193 IUPAC Name: 2H-tetrazole SMILES: C1=NNN=N1
| PubChem CID | 67519 |
|---|---|
| CAS | 288-94-8 |
| Molecular Weight (g/mol) | 70.055 |
| ChEBI | CHEBI:33193 |
| MDL Number | MFCD00005247 |
| SMILES | C1=NNN=N1 |
| IUPAC Name | 2H-tetrazole |
| InChI Key | KJUGUADJHNHALS-UHFFFAOYSA-N |
| Molecular Formula | CH2N4 |
Benzo[b]furan-3-acetonitrile, 99%
CAS: 52407-43-9 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.172 MDL Number: MFCD02183555 InChI Key: BJAJKVZABJZXDC-UHFFFAOYSA-N Synonym: 1-benzofuran-3-ylacetonitrile,3-benzo b furylacetonitrile,benzofuran-3-acetonitrile,2-benzofuran-3-yl acetonitrile,benzo b furan-3-acetonitrile,2-3-benzofuranyl acetonitrile,2-1-benzofuran-3-yl acetonitrile,2-benzo b furan-3-ylethanenitrile,pubchem7006,3-benzofuranylacetonitrile PubChem CID: 2769401 IUPAC Name: 2-(1-benzofuran-3-yl)acetonitrile SMILES: C1=CC=C2C(=C1)C(=CO2)CC#N
| PubChem CID | 2769401 |
|---|---|
| CAS | 52407-43-9 |
| Molecular Weight (g/mol) | 157.172 |
| MDL Number | MFCD02183555 |
| SMILES | C1=CC=C2C(=C1)C(=CO2)CC#N |
| Synonym | 1-benzofuran-3-ylacetonitrile,3-benzo b furylacetonitrile,benzofuran-3-acetonitrile,2-benzofuran-3-yl acetonitrile,benzo b furan-3-acetonitrile,2-3-benzofuranyl acetonitrile,2-1-benzofuran-3-yl acetonitrile,2-benzo b furan-3-ylethanenitrile,pubchem7006,3-benzofuranylacetonitrile |
| IUPAC Name | 2-(1-benzofuran-3-yl)acetonitrile |
| InChI Key | BJAJKVZABJZXDC-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
| Boiling Point | 77°C |
|---|---|
| Molecular Weight (g/mol) | 70.05 |
| ChEBI | CHEBI:33193 |
| Color | Cream to Orange |
| Physical Form | Crystalline Powder |
| Chemical Name or Material | Tetrazole |
| SMILES | C1=NNN=N1 |
| InChI Key | KJUGUADJHNHALS-UHFFFAOYSA-N |
| Density | 0.8000g/mL |
| PubChem CID | 67519 |
| CAS | 75-05-8 |
| Health Hazard 3 | GHS P Statement IF ON SKIN: Wash with plenty of soap and water. IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell. IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing. Wea |
| Health Hazard 2 | GHS H Statement Highly flammable liquid and vapour. Causes serious eye irritation. Harmful if swallowed. Harmful if inhaled. Harmful in contact with skin. |
| Packaging | AcroSeal™ Glass Bottle |
| Flash Point | 5°C |
| Health Hazard 1 | GHS Signal Word: Danger |
| IUPAC Name | 2H-tetrazole |
| Molecular Formula | CH2N4 |
| EINECS Number | 206-023-4 |
| Formula Weight | 70.05 |
| Specific Gravity | 0.8 |
2-(4-Methyl-1,3-thiazol-2-yl)acetonitrile, 97%, Thermo Scientific™
CAS: 19785-39-8 Molecular Formula: C6H6N2S Molecular Weight (g/mol): 138.19 MDL Number: MFCD03011392 InChI Key: XSRRCOBFMZWKJR-UHFFFAOYSA-N Synonym: 2-4-methyl-1,3-thiazol-2-yl acetonitrile,2-4-methylthiazol-2-yl acetonitrile,4-methyl-1,3-thiazol-2-yl acetonitrile,4-methyl-1,3-thiazole-2-yl acetonitrile,2-thiazoleacetonitrile,4-methyl,2-4-methyl-1,3-thiazol-2-yl ethanenitrile,2-thiazoleacetonitrile, 4-methyl,4-methyl-2-thiazoleacetonitrile,4-methylthiazole-2-acetonitrile,4-methylthiazol-2-yl-acetonitrile PubChem CID: 737184 IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)acetonitrile SMILES: CC1=CSC(CC#N)=N1
| PubChem CID | 737184 |
|---|---|
| CAS | 19785-39-8 |
| Molecular Weight (g/mol) | 138.19 |
| MDL Number | MFCD03011392 |
| SMILES | CC1=CSC(CC#N)=N1 |
| Synonym | 2-4-methyl-1,3-thiazol-2-yl acetonitrile,2-4-methylthiazol-2-yl acetonitrile,4-methyl-1,3-thiazol-2-yl acetonitrile,4-methyl-1,3-thiazole-2-yl acetonitrile,2-thiazoleacetonitrile,4-methyl,2-4-methyl-1,3-thiazol-2-yl ethanenitrile,2-thiazoleacetonitrile, 4-methyl,4-methyl-2-thiazoleacetonitrile,4-methylthiazole-2-acetonitrile,4-methylthiazol-2-yl-acetonitrile |
| IUPAC Name | 2-(4-methyl-1,3-thiazol-2-yl)acetonitrile |
| InChI Key | XSRRCOBFMZWKJR-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2S |
Indole-3-acetonitrile, TRC
CAS: 771-51-7 Molecular Formula: C10 H8 N2 Molecular Weight (g/mol): 156.18 Synonym: Indole-3-acetonitrile,3-Indoleacetonitrile IUPAC Name: 2-(1H-indol-3-yl)acetonitrile SMILES: N#CCc1c[nH]c2ccccc12
| CAS | 771-51-7 |
|---|---|
| Molecular Weight (g/mol) | 156.18 |
| SMILES | N#CCc1c[nH]c2ccccc12 |
| Synonym | Indole-3-acetonitrile,3-Indoleacetonitrile |
| IUPAC Name | 2-(1H-indol-3-yl)acetonitrile |
| Molecular Formula | C10 H8 N2 |
2-(2,2-Difluorobenzo[d][1,3]dioxol-5-yl)acetonitrile, TRC
CAS: 68119-31-3 Molecular Formula: C9H5NO2F2 Molecular Weight (g/mol): 197.14 SMILES: FC1(F)Oc2ccc(CC#N)cc2O1
| CAS | 68119-31-3 |
|---|---|
| Molecular Weight (g/mol) | 197.14 |
| SMILES | FC1(F)Oc2ccc(CC#N)cc2O1 |
| Molecular Formula | C9H5NO2F2 |
N-Iodosuccinimide, 97%
CAS: 516-12-1 Molecular Formula: C4H4INO2 Molecular Weight (g/mol): 224.99 MDL Number: MFCD00005512 InChI Key: LQZMLBORDGWNPD-UHFFFAOYSA-N Synonym: n-iodosuccinimide,succiniodimide,n-iodo succinimide,2,5-pyrrolidinedione, 1-iodo,unii-3cos3x3n4p,nis,succinimide, n-iodo,3cos3x3n4p,1-iodo-pyrrolidine-2,5-dione,1-iodoazolidine-2,5-dione PubChem CID: 120273 ChEBI: CHEBI:53204 IUPAC Name: 1-iodopyrrolidine-2,5-dione SMILES: IN1C(=O)CCC1=O
| PubChem CID | 120273 |
|---|---|
| CAS | 516-12-1 |
| Molecular Weight (g/mol) | 224.99 |
| ChEBI | CHEBI:53204 |
| MDL Number | MFCD00005512 |
| SMILES | IN1C(=O)CCC1=O |
| Synonym | n-iodosuccinimide,succiniodimide,n-iodo succinimide,2,5-pyrrolidinedione, 1-iodo,unii-3cos3x3n4p,nis,succinimide, n-iodo,3cos3x3n4p,1-iodo-pyrrolidine-2,5-dione,1-iodoazolidine-2,5-dione |
| IUPAC Name | 1-iodopyrrolidine-2,5-dione |
| InChI Key | LQZMLBORDGWNPD-UHFFFAOYSA-N |
| Molecular Formula | C4H4INO2 |
2-Pyridineacetonitrile, 97%
CAS: 2739-97-1 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00006346 InChI Key: UKVQBONVSSLJBB-UHFFFAOYSA-N Synonym: 2-pyridylacetonitrile,2-pyridineacetonitrile,pyridine-2-acetonitrile,2-pyridin-2-yl acetonitrile,2-2-pyridyl acetonitrile,2-cyanomethyl pyridine,pyridine-acetonitrile,pyridyl-2-acetonitrile,pyridin-2-ylacetonitrile,pyridin-2-yl acetonitrile PubChem CID: 75959 IUPAC Name: 2-pyridin-2-ylacetonitrile SMILES: C1=CC=NC(=C1)CC#N
| PubChem CID | 75959 |
|---|---|
| CAS | 2739-97-1 |
| Molecular Weight (g/mol) | 118.139 |
| MDL Number | MFCD00006346 |
| SMILES | C1=CC=NC(=C1)CC#N |
| Synonym | 2-pyridylacetonitrile,2-pyridineacetonitrile,pyridine-2-acetonitrile,2-pyridin-2-yl acetonitrile,2-2-pyridyl acetonitrile,2-cyanomethyl pyridine,pyridine-acetonitrile,pyridyl-2-acetonitrile,pyridin-2-ylacetonitrile,pyridin-2-yl acetonitrile |
| IUPAC Name | 2-pyridin-2-ylacetonitrile |
| InChI Key | UKVQBONVSSLJBB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
3-Thiopheneacetonitrile, 98%
CAS: 13781-53-8 Molecular Formula: C6H5NS Molecular Weight (g/mol): 123.17 MDL Number: MFCD00005471 InChI Key: GWZCLMWEJWPFFA-UHFFFAOYSA-N Synonym: 3-thiopheneacetonitrile,thiophene-3-acetonitrile,2-thiophen-3-yl acetonitrile,3-thienylacetonitrile,3-cyanomethylthiophene,3-thiophene acetonitrile,thien-3-ylacetonitrile,2-3-thienyl acetonitrile,thiophen-3-acetonitrile,2-3-thienyl ethanenitrile PubChem CID: 83730 IUPAC Name: 2-thiophen-3-ylacetonitrile SMILES: N#CCC1=CSC=C1
| PubChem CID | 83730 |
|---|---|
| CAS | 13781-53-8 |
| Molecular Weight (g/mol) | 123.17 |
| MDL Number | MFCD00005471 |
| SMILES | N#CCC1=CSC=C1 |
| Synonym | 3-thiopheneacetonitrile,thiophene-3-acetonitrile,2-thiophen-3-yl acetonitrile,3-thienylacetonitrile,3-cyanomethylthiophene,3-thiophene acetonitrile,thien-3-ylacetonitrile,2-3-thienyl acetonitrile,thiophen-3-acetonitrile,2-3-thienyl ethanenitrile |
| IUPAC Name | 2-thiophen-3-ylacetonitrile |
| InChI Key | GWZCLMWEJWPFFA-UHFFFAOYSA-N |
| Molecular Formula | C6H5NS |
2-Benzothiazoleacetonitrile, 98%
CAS: 56278-50-3 Molecular Formula: C9H6N2S Molecular Weight (g/mol): 174.221 MDL Number: MFCD00051633 InChI Key: ZMZSYUSDGRJZNT-UHFFFAOYSA-N Synonym: benzothiazole-2-acetonitrile,2-benzo d thiazol-2-yl acetonitrile,2-benzothiazoleacetonitrile,2-1,3-benzothiazol-2-yl acetonitrile,benzothiazole-2-yl-acetonitrile,1,3-benzothiazol-2-ylacetonitrile,benzothiazol-2-ylacetonitrile,2-cyanomethyl-1,3-benzothiazole,2-benzothiazol-2-ylethanenitrile,2-cyanomethylbenzothiazole PubChem CID: 342465 IUPAC Name: 2-(1,3-benzothiazol-2-yl)acetonitrile SMILES: C1=CC=C2C(=C1)N=C(S2)CC#N
| PubChem CID | 342465 |
|---|---|
| CAS | 56278-50-3 |
| Molecular Weight (g/mol) | 174.221 |
| MDL Number | MFCD00051633 |
| SMILES | C1=CC=C2C(=C1)N=C(S2)CC#N |
| Synonym | benzothiazole-2-acetonitrile,2-benzo d thiazol-2-yl acetonitrile,2-benzothiazoleacetonitrile,2-1,3-benzothiazol-2-yl acetonitrile,benzothiazole-2-yl-acetonitrile,1,3-benzothiazol-2-ylacetonitrile,benzothiazol-2-ylacetonitrile,2-cyanomethyl-1,3-benzothiazole,2-benzothiazol-2-ylethanenitrile,2-cyanomethylbenzothiazole |
| IUPAC Name | 2-(1,3-benzothiazol-2-yl)acetonitrile |
| InChI Key | ZMZSYUSDGRJZNT-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2S |
2-Benzimidazoleacetonitrile, 99%
CAS: 4414-88-4 Molecular Formula: C9H7N3 Molecular Weight (g/mol): 157.176 MDL Number: MFCD00005601 InChI Key: BWOVACANEIVHST-UHFFFAOYSA-N Synonym: 2-benzimidazolyl acetonitrile,2-cyanomethyl benzimidazole,1h-benzimidazole-2-acetonitrile,2-benzimidazoleacetonitrile,2-benzimidazolylacetonitrile,2-cyanomethylbenzimidazole,1h-benzimidazol-2-ylacetonitrile,2-kyanmethylbenzimidazol,benzimidazole, 2-cyanomethyl,2-1h-1,3-benzodiazol-2-yl acetonitrile PubChem CID: 20455 IUPAC Name: 2-(1H-benzimidazol-2-yl)acetonitrile SMILES: C1=CC=C2C(=C1)NC(=N2)CC#N
| PubChem CID | 20455 |
|---|---|
| CAS | 4414-88-4 |
| Molecular Weight (g/mol) | 157.176 |
| MDL Number | MFCD00005601 |
| SMILES | C1=CC=C2C(=C1)NC(=N2)CC#N |
| Synonym | 2-benzimidazolyl acetonitrile,2-cyanomethyl benzimidazole,1h-benzimidazole-2-acetonitrile,2-benzimidazoleacetonitrile,2-benzimidazolylacetonitrile,2-cyanomethylbenzimidazole,1h-benzimidazol-2-ylacetonitrile,2-kyanmethylbenzimidazol,benzimidazole, 2-cyanomethyl,2-1h-1,3-benzodiazol-2-yl acetonitrile |
| IUPAC Name | 2-(1H-benzimidazol-2-yl)acetonitrile |
| InChI Key | BWOVACANEIVHST-UHFFFAOYSA-N |
| Molecular Formula | C9H7N3 |
2-Pyridinesulfonylacetonitrile, 98%
CAS: 170449-34-0 Molecular Formula: C7H6N2O2S Molecular Weight (g/mol): 182.197 MDL Number: MFCD00041443 InChI Key: SAKACXZDAJXBCI-UHFFFAOYSA-N Synonym: 2-pyridinesulfonylacetonitrile,2-pyridinesulphonylacetonitrile,2-pyridin-2-ylsulfonyl acetonitrile,pyridine-2-sulfonylacetonitrile,2-pyridine-2-sulfonyl acetonitrile,pyridin-2-ylsulfonyl acetonitrile,2-2-pyridylsulfonyl ethanenitrile,maybridge1_004727,acmc-1c3jt,2-pyridinesulfonlyacetonitrile PubChem CID: 519355 IUPAC Name: 2-pyridin-2-ylsulfonylacetonitrile SMILES: C1=CC=NC(=C1)S(=O)(=O)CC#N
| PubChem CID | 519355 |
|---|---|
| CAS | 170449-34-0 |
| Molecular Weight (g/mol) | 182.197 |
| MDL Number | MFCD00041443 |
| SMILES | C1=CC=NC(=C1)S(=O)(=O)CC#N |
| Synonym | 2-pyridinesulfonylacetonitrile,2-pyridinesulphonylacetonitrile,2-pyridin-2-ylsulfonyl acetonitrile,pyridine-2-sulfonylacetonitrile,2-pyridine-2-sulfonyl acetonitrile,pyridin-2-ylsulfonyl acetonitrile,2-2-pyridylsulfonyl ethanenitrile,maybridge1_004727,acmc-1c3jt,2-pyridinesulfonlyacetonitrile |
| IUPAC Name | 2-pyridin-2-ylsulfonylacetonitrile |
| InChI Key | SAKACXZDAJXBCI-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2O2S |
3,4-(Methylenedioxy)phenylacetonitrile, 98+%
CAS: 4439-02-5 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005835 InChI Key: ZQPBOYASBNAXOZ-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy phenylacetonitrile,1,3-benzodioxole-5-acetonitrile,3,4-methylenedioxyphenylacetonitrile,2-benzo d 1,3 dioxol-5-yl acetonitrile,3,4-methylenedioxybenzyl cyanide,2-2h-1,3-benzodioxol-5-yl acetonitrile,1,3-benzodioxol-5-ylacetonitrile,2-1,3-benzodioxol-5-yl acetonitrile,3,4-methylenedioxybenzylcyanide,homopiperonylonitrile PubChem CID: 78178 IUPAC Name: 2-(1,3-benzodioxol-5-yl)acetonitrile SMILES: C1OC2=C(O1)C=C(C=C2)CC#N
| PubChem CID | 78178 |
|---|---|
| CAS | 4439-02-5 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD00005835 |
| SMILES | C1OC2=C(O1)C=C(C=C2)CC#N |
| Synonym | 3,4-methylenedioxy phenylacetonitrile,1,3-benzodioxole-5-acetonitrile,3,4-methylenedioxyphenylacetonitrile,2-benzo d 1,3 dioxol-5-yl acetonitrile,3,4-methylenedioxybenzyl cyanide,2-2h-1,3-benzodioxol-5-yl acetonitrile,1,3-benzodioxol-5-ylacetonitrile,2-1,3-benzodioxol-5-yl acetonitrile,3,4-methylenedioxybenzylcyanide,homopiperonylonitrile |
| IUPAC Name | 2-(1,3-benzodioxol-5-yl)acetonitrile |
| InChI Key | ZQPBOYASBNAXOZ-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |