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Oxanes

Organic heterocyclic compounds that consist of a saturated six-membered ring with five carbon atoms and one oxygen atom.

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1

Tetrahydropyran, 99%

CAS: 142-68-7 MDL Number: MFCD00006585 InChI Key: DHXVGJBLRPWPCS-UHFFFAOYSA-N Synonym: tetrahydropyran,tetrahydro-2h-pyran,oxacyclohexane,pentamethylene oxide,2h-pyran, tetrahydro,tetrahydropyrane,unii-v06i3ilg6b,2h-tetrahydropyran,v06i3ilg6b,pye PubChem CID: 8894 ChEBI: CHEBI:46941 IUPAC Name: oxane SMILES: C1CCOCC1

PubChem CID 8894
CAS 142-68-7
ChEBI CHEBI:46941
MDL Number MFCD00006585
SMILES C1CCOCC1
Synonym tetrahydropyran,tetrahydro-2h-pyran,oxacyclohexane,pentamethylene oxide,2h-pyran, tetrahydro,tetrahydropyrane,unii-v06i3ilg6b,2h-tetrahydropyran,v06i3ilg6b,pye
IUPAC Name oxane
InChI Key DHXVGJBLRPWPCS-UHFFFAOYSA-N
2

Cineole, Approx. 99%, MP Biomedicals™

CAS: 470-82-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00167977 InChI Key: WEEGYLXZBRQIMU-UHFFFAOYSA-N Synonym: eucalyptol,cineole,1,8-cineole,1,8-cineol,cajeputol,1,8-epoxy-p-menthane,eucalyptole,zineol,eucapur,terpan PubChem CID: 2758 IUPAC Name: 1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane SMILES: CC12CCC(CC1)C(C)(C)O2

PubChem CID 2758
CAS 470-82-6
Molecular Weight (g/mol) 154.25
MDL Number MFCD00167977
SMILES CC12CCC(CC1)C(C)(C)O2
Synonym eucalyptol,cineole,1,8-cineole,1,8-cineol,cajeputol,1,8-epoxy-p-menthane,eucalyptole,zineol,eucapur,terpan
IUPAC Name 1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane
InChI Key WEEGYLXZBRQIMU-UHFFFAOYSA-N
Molecular Formula C10H18O
3

2-(3-Bromopropoxy)tetrahydro-2H-pyran, 98%, stabilized with potassium carbonate, Thermo Scientific Chemicals

CAS: 33821-94-2 Molecular Formula: C8H15BrO2 Molecular Weight (g/mol): 223.1 InChI Key: HJNHUFQGDJLQRS-UHFFFAOYSA-N Synonym: 2-3-bromopropoxy tetrahydro-2h-pyran,2-3-bromopropoxy oxane,2-3-bromopropoxy-tetrahydro-2h-pyran,2-3-bromopropoxy tetrahydropyran,1-bromo-3-tetrahydropyranyloxypropane,2-3-bromo-propoxy-tetrahydro-pyran,2h-pyran, 2-3-bromopropoxy tetrahydro,acmc-1cjr6,1-bromo-3-2-oxanyloxy propane PubChem CID: 2777988 IUPAC Name: 2-(3-bromopropoxy)oxane SMILES: C1CCOC(C1)OCCCBr

PubChem CID 2777988
CAS 33821-94-2
Molecular Weight (g/mol) 223.1
SMILES C1CCOC(C1)OCCCBr
Synonym 2-3-bromopropoxy tetrahydro-2h-pyran,2-3-bromopropoxy oxane,2-3-bromopropoxy-tetrahydro-2h-pyran,2-3-bromopropoxy tetrahydropyran,1-bromo-3-tetrahydropyranyloxypropane,2-3-bromo-propoxy-tetrahydro-pyran,2h-pyran, 2-3-bromopropoxy tetrahydro,acmc-1cjr6,1-bromo-3-2-oxanyloxy propane
IUPAC Name 2-(3-bromopropoxy)oxane
InChI Key HJNHUFQGDJLQRS-UHFFFAOYSA-N
Molecular Formula C8H15BrO2
4

Tetrahydropyran, 98+%

CAS: 142-68-7 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.134 MDL Number: MFCD00006585 InChI Key: DHXVGJBLRPWPCS-UHFFFAOYSA-N Synonym: tetrahydropyran,tetrahydro-2h-pyran,oxacyclohexane,pentamethylene oxide,2h-pyran, tetrahydro,tetrahydropyrane,unii-v06i3ilg6b,2h-tetrahydropyran,v06i3ilg6b,pye PubChem CID: 8894 ChEBI: CHEBI:46941 IUPAC Name: oxane SMILES: C1CCOCC1

PubChem CID 8894
CAS 142-68-7
Molecular Weight (g/mol) 86.134
ChEBI CHEBI:46941
MDL Number MFCD00006585
SMILES C1CCOCC1
Synonym tetrahydropyran,tetrahydro-2h-pyran,oxacyclohexane,pentamethylene oxide,2h-pyran, tetrahydro,tetrahydropyrane,unii-v06i3ilg6b,2h-tetrahydropyran,v06i3ilg6b,pye
IUPAC Name oxane
InChI Key DHXVGJBLRPWPCS-UHFFFAOYSA-N
Molecular Formula C5H10O
5

4-Acetyltetrahydropyran, 97%

CAS: 137052-08-5 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD08704647 InChI Key: VNMXIOWPBADSIC-UHFFFAOYSA-N Synonym: 1-tetrahydro-2h-pyran-4-yl ethanone,1-oxan-4-yl ethan-1-one,1-oxan-4-yl ethanone,4-acetyltetrahydropyran,1-tetrahydro-2h-pyran-4-ylethanone,4-acetyltetrahydro-4h-pyran,4-acetyltetrahydro-2h-pyran,1-tetrahydropyran-4-ylethanone,1-tetrahydro-pyran-4-yl-ethanone,1-tetrahydro-2h-pyran-4-yl ethan-1-one PubChem CID: 9877365 IUPAC Name: 1-(oxan-4-yl)ethanone SMILES: CC(=O)C1CCOCC1

PubChem CID 9877365
CAS 137052-08-5
Molecular Weight (g/mol) 128.171
MDL Number MFCD08704647
SMILES CC(=O)C1CCOCC1
Synonym 1-tetrahydro-2h-pyran-4-yl ethanone,1-oxan-4-yl ethan-1-one,1-oxan-4-yl ethanone,4-acetyltetrahydropyran,1-tetrahydro-2h-pyran-4-ylethanone,4-acetyltetrahydro-4h-pyran,4-acetyltetrahydro-2h-pyran,1-tetrahydropyran-4-ylethanone,1-tetrahydro-pyran-4-yl-ethanone,1-tetrahydro-2h-pyran-4-yl ethan-1-one
IUPAC Name 1-(oxan-4-yl)ethanone
InChI Key VNMXIOWPBADSIC-UHFFFAOYSA-N
Molecular Formula C7H12O2
6

4-(Hydroxymethyl)tetrahydropyran, 98%

CAS: 14774-37-9 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00457804 InChI Key: YSNVSVCWTBLLRW-UHFFFAOYSA-N Synonym: tetrahydropyran-4-methanol,tetrahydro-2h-pyran-4-yl methanol,4-hydroxymethyl tetrahydropyran,oxan-4-yl methanol,tetrahydro-pyran-4-yl-methanol,tetrahydro-2h-pyran-4-ylmethanol,2h-pyran-4-methanol, tetrahydro,4-hydroxymethyltetrahydropyran,oxan-4-yl-methanol PubChem CID: 2773573 SMILES: OCC1CCOCC1

PubChem CID 2773573
CAS 14774-37-9
Molecular Weight (g/mol) 116.16
MDL Number MFCD00457804
SMILES OCC1CCOCC1
Synonym tetrahydropyran-4-methanol,tetrahydro-2h-pyran-4-yl methanol,4-hydroxymethyl tetrahydropyran,oxan-4-yl methanol,tetrahydro-pyran-4-yl-methanol,tetrahydro-2h-pyran-4-ylmethanol,2h-pyran-4-methanol, tetrahydro,4-hydroxymethyltetrahydropyran,oxan-4-yl-methanol
InChI Key YSNVSVCWTBLLRW-UHFFFAOYSA-N
Molecular Formula C6H12O2
7

1,8-Cineole, 99%

CAS: 470-82-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00167977 InChI Key: WEEGYLXZBRQIMU-UHFFFAOYSA-N Synonym: eucalyptol,cineole,1,8-cineole,1,8-cineol,cajeputol,1,8-epoxy-p-menthane,eucalyptole,zineol,eucapur,terpan PubChem CID: 2758 IUPAC Name: 2,2,4-trimethyl-3-oxabicyclo[2.2.2]octane SMILES: CC12CCC(CC1)C(C)(C)O2

PubChem CID 2758
CAS 470-82-6
Molecular Weight (g/mol) 154.25
MDL Number MFCD00167977
SMILES CC12CCC(CC1)C(C)(C)O2
Synonym eucalyptol,cineole,1,8-cineole,1,8-cineol,cajeputol,1,8-epoxy-p-menthane,eucalyptole,zineol,eucapur,terpan
IUPAC Name 2,2,4-trimethyl-3-oxabicyclo[2.2.2]octane
InChI Key WEEGYLXZBRQIMU-UHFFFAOYSA-N
Molecular Formula C10H18O
8

Artemether Tetrahydrofuran Acetate, TRC

CAS: 181528-64-3 Molecular Formula: C16H26O5 Molecular Weight (g/mol): 298.37 Synonym: (3aS,4R,6aS,7R,8S,10R,10aR)-Octahydro-8-methoxy-4,7-dimethyl-2H,10H-furo[3,2-i][2]benzopyran-10-ol 10-Acetate,,[3aS-(3aα,4α,6aα,7β,8β,10α,10aS*)]-Octahydro-8-methoxy-4,7-dimethyl-2H,10H-furo[3,2-i][2]benzopyran-10-ol Acetate,Artemether Ph. Int. Impurity C IUPAC Name: [(3aS,4R,6aS,7R,8S,10R,10aR)-8-methoxy-4,7-dimethyl-2,3,3a,4,5,6,6a,7,8,10-decahydrofuro[3,2-i]isochromen-10-yl] acetate SMILES: C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@@H]([C@@]23[C@H]1CCO3)OC(=O)C)OC)C

CAS 181528-64-3
Molecular Weight (g/mol) 298.37
SMILES C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@@H]([C@@]23[C@H]1CCO3)OC(=O)C)OC)C
Synonym (3aS,4R,6aS,7R,8S,10R,10aR)-Octahydro-8-methoxy-4,7-dimethyl-2H,10H-furo[3,2-i][2]benzopyran-10-ol 10-Acetate,,[3aS-(3aα,4α,6aα,7β,8β,10α,10aS*)]-Octahydro-8-methoxy-4,7-dimethyl-2H,10H-furo[3,2-i][2]benzopyran-10-ol Acetate,Artemether Ph. Int. Impurity C
IUPAC Name [(3aS,4R,6aS,7R,8S,10R,10aR)-8-methoxy-4,7-dimethyl-2,3,3a,4,5,6,6a,7,8,10-decahydrofuro[3,2-i]isochromen-10-yl] acetate
Molecular Formula C16H26O5
9

Lincomycin Sulfoxide, TRC

CAS: 22083-92-7 Molecular Formula: C18H34N2O7S Molecular Weight (g/mol): 422.54 Synonym: (2S,4R)-N-((1R,2R)-2-Hydroxy-1-((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfinyl)tetrahydro-2H-pyran-2-yl)propyl)-1-methyl-4-propylpyrrolidine-2-carboxamide;1,6,8-Trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-(methylsulfinyl)-D-erythro-alpha-D-galacto-octopyranose;1,6,8-Trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-(methylsulfinyl)-D-erythro-alpha-D-galacto-octopyranose;[2S-(2alpha,4beta)]-1,6,8-Trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-1,6,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-(methylsulfinyl)-D-erythro-alpha-D-galacto-octopyranose,trans- alpha- 1,6,8-trideoxy-6-(1-methyl-4-propyl-L-2-pyrrolidinecarboxamido)-1-(methylsulfinyl)-D-erythro-D-galacto-octopyranose;Lincomycin S-oxide; SMILES: CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@@H](C)O)[C@H]2O[C@@H]([C@H](O)[C@@H](O)[C@H]2O)S(=O)C

CAS 22083-92-7
Molecular Weight (g/mol) 422.54
SMILES CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@@H](C)O)[C@H]2O[C@@H]([C@H](O)[C@@H](O)[C@H]2O)S(=O)C
Synonym (2S,4R)-N-((1R,2R)-2-Hydroxy-1-((2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(methylsulfinyl)tetrahydro-2H-pyran-2-yl)propyl)-1-methyl-4-propylpyrrolidine-2-carboxamide;1,6,8-Trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-(methylsulfinyl)-D-erythro-alpha-D-galacto-octopyranose;1,6,8-Trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-pyrrolidinyl]carbonyl]amino]-1-(methylsulfinyl)-D-erythro-alpha-D-galacto-octopyranose;[2S-(2alpha,4beta)]-1,6,8-Trideoxy-6-[[[(2S,4R)-1-methyl-4-propyl-2-1,6,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-(methylsulfinyl)-D-erythro-alpha-D-galacto-octopyranose,trans- alpha- 1,6,8-trideoxy-6-(1-methyl-4-propyl-L-2-pyrrolidinecarboxamido)-1-(methylsulfinyl)-D-erythro-D-galacto-octopyranose;Lincomycin S-oxide;
Molecular Formula C18H34N2O7S
10

Oxychlordane, TRC

CAS: 27304-13-8 Molecular Formula: C10 H4 Cl8 O Molecular Weight (g/mol): 423.76 Synonym: 2,5-Methano-2H-indeno[1,2-b]oxirene, 2,3,4,5,6,6a,7,7-octachloro-1a,1b,5,5a,6,6a-hexahydro-, (1aα,1bβ,2α,5α,5aβ,6β,6aα)-,4,7-Methanoindan, 1,2,4,5,6,7,8,8-octachloro-2,3-epoxy-3a,4,7,7a-tetrahydro-, exo,endo- (8CI),rel-(1aR,1bS,2R,5S,5aR,6S,6aS)-2,3,4,5,6,6a,7,7-Octachloro-1a,1b,5,5a,6,6a-hexahydro-2,5-methano-2H-indeno[1,2-b]oxirene,(±)-Oxychlordane,Octachlor epoxide,Oxychlordan,Oxychlordane SMILES: Cl[C@@H]1[C@@H]2[C@H]([C@@H]3O[C@]13Cl)[C@]4(Cl)C(=C(Cl)[C@@]2(Cl)C4(Cl)Cl)Cl

CAS 27304-13-8
Molecular Weight (g/mol) 423.76
SMILES Cl[C@@H]1[C@@H]2[C@H]([C@@H]3O[C@]13Cl)[C@]4(Cl)C(=C(Cl)[C@@]2(Cl)C4(Cl)Cl)Cl
Synonym 2,5-Methano-2H-indeno[1,2-b]oxirene, 2,3,4,5,6,6a,7,7-octachloro-1a,1b,5,5a,6,6a-hexahydro-, (1aα,1bβ,2α,5α,5aβ,6β,6aα)-,4,7-Methanoindan, 1,2,4,5,6,7,8,8-octachloro-2,3-epoxy-3a,4,7,7a-tetrahydro-, exo,endo- (8CI),rel-(1aR,1bS,2R,5S,5aR,6S,6aS)-2,3,4,5,6,6a,7,7-Octachloro-1a,1b,5,5a,6,6a-hexahydro-2,5-methano-2H-indeno[1,2-b]oxirene,(±)-Oxychlordane,Octachlor epoxide,Oxychlordan,Oxychlordane
Molecular Formula C10 H4 Cl8 O
11

[1-(Tetrahydropyran-2-yl)-1H-pyrazol-5-yl]boronic Acid Pinacol Ester, TRC

CAS: 903550-26-5 Molecular Formula: C14H23BN2O3 Molecular Weight (g/mol): 278.15 Synonym: 1-(Tetrahydro-2H-pyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole,1-(Oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole,1-(Oxan-2-yl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole,1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazole-5-boronic Acid Pinacol Ester,1-(Tetrahydropyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole,1-Tetrahydropyran-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole IUPAC Name: 1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole SMILES: CC1(C)OB(OC1(C)C)c2ccnn2C3CCCCO3

CAS 903550-26-5
Molecular Weight (g/mol) 278.15
SMILES CC1(C)OB(OC1(C)C)c2ccnn2C3CCCCO3
Synonym 1-(Tetrahydro-2H-pyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole,1-(Oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole,1-(Oxan-2-yl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole,1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazole-5-boronic Acid Pinacol Ester,1-(Tetrahydropyran-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole,1-Tetrahydropyran-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
IUPAC Name 1-(oxan-2-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole
Molecular Formula C14H23BN2O3