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Organic phosphoric acids and derivatives

Organic compounds that consist of phosphoric acid with organic functional group substitutions; includes compounds that are derived from organic phosphoric acids.

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Triethyl phosphate, 99%

CAS: 78-40-0 Molecular Formula: C6H15O4P Molecular Weight (g/mol): 182.16 MDL Number: MFCD00009077 InChI Key: DQWPFSLDHJDLRL-UHFFFAOYSA-N Synonym: triethylphosphate,phosphoric acid, triethyl ester,tris ethyl phosphate,triethoxyphosphine oxide,triethylfosfat,ethyl phosphate eto 3po,triethylfosfat czech,ethyl phosphate van,unii-qih4k96k7j,phosphoric acid triethyl ester PubChem CID: 6535 ChEBI: CHEBI:45927 IUPAC Name: triethyl phosphate SMILES: CCOP(=O)(OCC)OCC

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PubChem CID 6535
CAS 78-40-0
Molecular Weight (g/mol) 182.16
ChEBI CHEBI:45927
MDL Number MFCD00009077
SMILES CCOP(=O)(OCC)OCC
Synonym triethylphosphate,phosphoric acid, triethyl ester,tris ethyl phosphate,triethoxyphosphine oxide,triethylfosfat,ethyl phosphate eto 3po,triethylfosfat czech,ethyl phosphate van,unii-qih4k96k7j,phosphoric acid triethyl ester
IUPAC Name triethyl phosphate
InChI Key DQWPFSLDHJDLRL-UHFFFAOYSA-N
Molecular Formula C6H15O4P
2

Dibenzyl phosphate, 98%

CAS: 1623-08-1 Molecular Formula: C14H15O4P Molecular Weight (g/mol): 278.23 MDL Number: MFCD00004775 InChI Key: HDFFVHSMHLDSLO-UHFFFAOYSA-N Synonym: dibenzyl phosphate,phosphoric acid dibenzyl ester,dibenzylphosphoric acid,unii-y65r35lz0s,phosphoric acid, bis phenylmethyl ester,dibenzylphosphate,creatine phosphate disodium impurity 4,dibenzyloxyphosphinic acid,dibenzyl-phosphate,pubchem14883 PubChem CID: 74189 IUPAC Name: dibenzyl hydrogen phosphate SMILES: C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2

PubChem CID 74189
CAS 1623-08-1
Molecular Weight (g/mol) 278.23
MDL Number MFCD00004775
SMILES C1=CC=C(C=C1)COP(=O)(O)OCC2=CC=CC=C2
Synonym dibenzyl phosphate,phosphoric acid dibenzyl ester,dibenzylphosphoric acid,unii-y65r35lz0s,phosphoric acid, bis phenylmethyl ester,dibenzylphosphate,creatine phosphate disodium impurity 4,dibenzyloxyphosphinic acid,dibenzyl-phosphate,pubchem14883
IUPAC Name dibenzyl hydrogen phosphate
InChI Key HDFFVHSMHLDSLO-UHFFFAOYSA-N
Molecular Formula C14H15O4P
3
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Triphenyl phosphate, 99+%

CAS: 115-86-6 Molecular Formula: C18H15O4P Molecular Weight (g/mol): 326.29 MDL Number: MFCD00003031 InChI Key: XZZNDPSIHUTMOC-UHFFFAOYSA-N Synonym: triphenylphosphate,phosphoric acid, triphenyl ester,disflamoll tp,triphenoxyphosphine oxide,celluflex tpp,phosflex tpp,trifenylfosfat,phenyl phosphate pho 3po,phosphoric acid triphenyl ester,trifenylfosfat czech PubChem CID: 8289 ChEBI: CHEBI:35033 IUPAC Name: triphenyl phosphate SMILES: O=P(OC1=CC=CC=C1)(OC1=CC=CC=C1)OC1=CC=CC=C1

PubChem CID 8289
CAS 115-86-6
Molecular Weight (g/mol) 326.29
ChEBI CHEBI:35033
MDL Number MFCD00003031
SMILES O=P(OC1=CC=CC=C1)(OC1=CC=CC=C1)OC1=CC=CC=C1
Synonym triphenylphosphate,phosphoric acid, triphenyl ester,disflamoll tp,triphenoxyphosphine oxide,celluflex tpp,phosflex tpp,trifenylfosfat,phenyl phosphate pho 3po,phosphoric acid triphenyl ester,trifenylfosfat czech
IUPAC Name triphenyl phosphate
InChI Key XZZNDPSIHUTMOC-UHFFFAOYSA-N
Molecular Formula C18H15O4P
4

Adenosine 5'-monophosphate, 99%

CAS: 61-19-8 Molecular Formula: C10H14N5O7P Molecular Weight (g/mol): 347.22 MDL Number: MFCD00005750 InChI Key: UDMBCSSLTHHNCD-YPLCUDRINA-N Synonym: adenosine 5'-monophosphate,5'-adenylic acid,adenosine monophosphate,adenosine phosphate,adenylic acid,adenylate,phosphaden,5'-amp,adenosine 5'-phosphate,phosphentaside PubChem CID: 6083 ChEBI: CHEBI:16027 IUPAC Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate SMILES: NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1

PubChem CID 6083
CAS 61-19-8
Molecular Weight (g/mol) 347.22
ChEBI CHEBI:16027
MDL Number MFCD00005750
SMILES NC1=C2N=CN([C@@H]3O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]3O)C2=NC=N1
Synonym adenosine 5'-monophosphate,5'-adenylic acid,adenosine monophosphate,adenosine phosphate,adenylic acid,adenylate,phosphaden,5'-amp,adenosine 5'-phosphate,phosphentaside
IUPAC Name [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
InChI Key UDMBCSSLTHHNCD-YPLCUDRINA-N
Molecular Formula C10H14N5O7P
5

Diphenyl p-Hydroxyphenyl Phosphate, TRC

CAS: 56806-74-7 Molecular Formula: C18H15O5P Molecular Weight (g/mol): 342.28 Synonym: Hydroquinonyldiphenyl Phosphate,Diphenyl p-Hydroxyphenylphosphoric Acid Ester; SMILES: Oc1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1

CAS 56806-74-7
Molecular Weight (g/mol) 342.28
SMILES Oc1ccc(OP(=O)(Oc2ccccc2)Oc3ccccc3)cc1
Synonym Hydroquinonyldiphenyl Phosphate,Diphenyl p-Hydroxyphenylphosphoric Acid Ester;
Molecular Formula C18H15O5P
6

Butyl Phenyl Phosphate, TRC

CAS: 2752-95-6 Molecular Formula: C16 H19 O4 P Molecular Weight (g/mol): 306.29 Synonym: Butyl phenyl phosphate,Butyl phenyl phosphate IUPAC Name: butyl diphenyl phosphate SMILES: CCCCOP(=O)(Oc1ccccc1)Oc2ccccc2

CAS 2752-95-6
Molecular Weight (g/mol) 306.29
SMILES CCCCOP(=O)(Oc1ccccc1)Oc2ccccc2
Synonym Butyl phenyl phosphate,Butyl phenyl phosphate
IUPAC Name butyl diphenyl phosphate
Molecular Formula C16 H19 O4 P
7

Tri-o-tolyl phosphate, 96%

CAS: 78-30-8 Molecular Formula: C21H21O4P Molecular Weight (g/mol): 368.37 MDL Number: MFCD00041906 InChI Key: YSMRWXYRXBRSND-UHFFFAOYSA-N Synonym: tri-o-cresyl phosphate,tri-o-tolyl phosphate,o-tolyl phosphate,tocp,totp,phosphoric acid, tris 2-methylphenyl ester,o-cresyl phosphate,triorthocresyl phosphate,phosflex 179c,tri-2-tolyl phosphate PubChem CID: 6527 IUPAC Name: tris(2-methylphenyl) phosphate SMILES: CC1=CC=CC=C1OP(=O)(OC1=CC=CC=C1C)OC1=CC=CC=C1C

PubChem CID 6527
CAS 78-30-8
Molecular Weight (g/mol) 368.37
MDL Number MFCD00041906
SMILES CC1=CC=CC=C1OP(=O)(OC1=CC=CC=C1C)OC1=CC=CC=C1C
Synonym tri-o-cresyl phosphate,tri-o-tolyl phosphate,o-tolyl phosphate,tocp,totp,phosphoric acid, tris 2-methylphenyl ester,o-cresyl phosphate,triorthocresyl phosphate,phosflex 179c,tri-2-tolyl phosphate
IUPAC Name tris(2-methylphenyl) phosphate
InChI Key YSMRWXYRXBRSND-UHFFFAOYSA-N
Molecular Formula C21H21O4P
8

Naphthol AS-BI phosphate, 93%

CAS: 1919-91-1 Molecular Formula: C18H15BrNO6P Molecular Weight (g/mol): 452.2 MDL Number: MFCD00004058 InChI Key: HUXIAXQSTATULQ-UHFFFAOYSA-N Synonym: naphthol as-bi phosphate,naphthol as bi phosphate,7-bromo-3-hydroxy-2-naphthoic-o-anisidide phosphate,2-naphthalenecarboxamide, 7-bromo-n-2-methoxyphenyl-3-phosphonooxy,naphthol as-bi phosphoric acid,naphthol as-bi phosphoric acid solution,6-bromo-3-2-methoxyphenyl carbamoyl naphthalen-2-yl oxyphosphonic acid,6-bromo-3-2-methoxyphenyl carbamoyl naphthalen-2-yl dihydrogen phosphate,2-naphthalenecarboxamide,7-bromo-n-2-methoxyphenyl-3-phosphonooxy-, sodium salt 1:2,naphthol as-bl phosphate PubChem CID: 74715 IUPAC Name: [6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate SMILES: COC1=CC=CC=C1NC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)OP(=O)(O)O

PubChem CID 74715
CAS 1919-91-1
Molecular Weight (g/mol) 452.2
MDL Number MFCD00004058
SMILES COC1=CC=CC=C1NC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)OP(=O)(O)O
Synonym naphthol as-bi phosphate,naphthol as bi phosphate,7-bromo-3-hydroxy-2-naphthoic-o-anisidide phosphate,2-naphthalenecarboxamide, 7-bromo-n-2-methoxyphenyl-3-phosphonooxy,naphthol as-bi phosphoric acid,naphthol as-bi phosphoric acid solution,6-bromo-3-2-methoxyphenyl carbamoyl naphthalen-2-yl oxyphosphonic acid,6-bromo-3-2-methoxyphenyl carbamoyl naphthalen-2-yl dihydrogen phosphate,2-naphthalenecarboxamide,7-bromo-n-2-methoxyphenyl-3-phosphonooxy-, sodium salt 1:2,naphthol as-bl phosphate
IUPAC Name [6-bromo-3-[(2-methoxyphenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate
InChI Key HUXIAXQSTATULQ-UHFFFAOYSA-N
Molecular Formula C18H15BrNO6P
9

Octyl Phenyl Phosphate, TRC

CAS: 115-88-8 Molecular Formula: C20 H27 O4 P Molecular Weight (g/mol): 362.4 Synonym: Diphenyl Octyl Phosphate,Octyl diphenyl phosphate IUPAC Name: octyl diphenyl phosphate SMILES: CCCCCCCCOP(=O)(Oc1ccccc1)Oc2ccccc2

CAS 115-88-8
Molecular Weight (g/mol) 362.4
SMILES CCCCCCCCOP(=O)(Oc1ccccc1)Oc2ccccc2
Synonym Diphenyl Octyl Phosphate,Octyl diphenyl phosphate
IUPAC Name octyl diphenyl phosphate
Molecular Formula C20 H27 O4 P
10

Bis(2-butoxyethyl) 2-Hydroxyethyl Phosphate Triester, TRC

CAS: 1477494-86-2 Molecular Formula: C14 H31 O7 P Molecular Weight (g/mol): 342.36 Synonym: Bis(2-butoxyethyl) 2-Hydroxyethyl Phosphate Triester,Bis(2-butoxyethyl) 2-Hydroxyethyl Ester Phosphoric Acid; IUPAC Name: bis(2-butoxyethyl) 2-hydroxyethyl phosphate SMILES: CCCCOCCOP(=O)(OCCO)OCCOCCCC

CAS 1477494-86-2
Molecular Weight (g/mol) 342.36
SMILES CCCCOCCOP(=O)(OCCO)OCCOCCCC
Synonym Bis(2-butoxyethyl) 2-Hydroxyethyl Phosphate Triester,Bis(2-butoxyethyl) 2-Hydroxyethyl Ester Phosphoric Acid;
IUPAC Name bis(2-butoxyethyl) 2-hydroxyethyl phosphate
Molecular Formula C14 H31 O7 P
11

Bis(2,3-dibromopropyl) Phosphate, TRC

CAS: 5412-25-9 Molecular Formula: C6H11Br4O4P Molecular Weight (g/mol): 497.74 Synonym: 2,3-Dibromo-1-propanol 1,1’-(Hydrogen Phosphate),Bis(2,3-dibromopropyl) Hydrogen Phosphate,Bis(2,3-dibromopropyl) Phosphate,NSC 3239 IUPAC Name: bis(2,3-dibromopropyl) hydrogen phosphate SMILES: C(C(CBr)Br)OP(=O)(O)OCC(CBr)Br

CAS 5412-25-9
Molecular Weight (g/mol) 497.74
SMILES C(C(CBr)Br)OP(=O)(O)OCC(CBr)Br
Synonym 2,3-Dibromo-1-propanol 1,1’-(Hydrogen Phosphate),Bis(2,3-dibromopropyl) Hydrogen Phosphate,Bis(2,3-dibromopropyl) Phosphate,NSC 3239
IUPAC Name bis(2,3-dibromopropyl) hydrogen phosphate
Molecular Formula C6H11Br4O4P
12

Isodecyl Diphenyl Phosphate, TRC

CAS: 29761-21-5 Molecular Formula: C22H31O4P Molecular Weight (g/mol): 390.45 Synonym: Phosflex 390; IUPAC Name: 8-methylnonyl diphenyl phosphate SMILES: O=P(OC1=CC=CC=C1)(OC2=CC=CC=C2)OCCCCCCCC(C)C

CAS 29761-21-5
Molecular Weight (g/mol) 390.45
SMILES O=P(OC1=CC=CC=C1)(OC2=CC=CC=C2)OCCCCCCCC(C)C
Synonym Phosflex 390;
IUPAC Name 8-methylnonyl diphenyl phosphate
Molecular Formula C22H31O4P
13

Bis(2-butoxyethyl) 2-(3-Hydroxybutoxy)ethyl Phosphate Triester, TRC

CAS: 1477494-87-3 Molecular Formula: C18H39O8P Molecular Weight (g/mol): 414.47 Synonym: Bis(2-butoxyethyl) 2-(3-hydroxybutoxy)ethyl ester Phosphoric Acid IUPAC Name: bis(2-butoxyethyl) 2-(3-hydroxybutoxy)ethyl phosphate SMILES: CC(O)CCOCCOP(OCCOCCCC)(OCCOCCCC)=O

CAS 1477494-87-3
Molecular Weight (g/mol) 414.47
SMILES CC(O)CCOCCOP(OCCOCCCC)(OCCOCCCC)=O
Synonym Bis(2-butoxyethyl) 2-(3-hydroxybutoxy)ethyl ester Phosphoric Acid
IUPAC Name bis(2-butoxyethyl) 2-(3-hydroxybutoxy)ethyl phosphate
Molecular Formula C18H39O8P
14

4-Isopropylphenyl Diphenyl Phosphate, TRC

CAS: 55864-04-5 Molecular Formula: C21H21O4P Molecular Weight (g/mol): 368.36 Synonym: p-Cumenyl Phenyl Phosphate,Diphenyl 4-isopropylphenyl Phosphate,p-Isopropylphenyl Diphenyl Phosphate IUPAC Name: diphenyl (4-propan-2-ylphenyl) phosphate SMILES: O=P(OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=C(C(C)C)C=C3

CAS 55864-04-5
Molecular Weight (g/mol) 368.36
SMILES O=P(OC1=CC=CC=C1)(OC2=CC=CC=C2)OC3=CC=C(C(C)C)C=C3
Synonym p-Cumenyl Phenyl Phosphate,Diphenyl 4-isopropylphenyl Phosphate,p-Isopropylphenyl Diphenyl Phosphate
IUPAC Name diphenyl (4-propan-2-ylphenyl) phosphate
Molecular Formula C21H21O4P
15

2-Isopropylphenyl Diphenyl Phosphate, TRC

CAS: 64532-94-1 Molecular Formula: C21H21O4P Molecular Weight (g/mol): 368.36 Synonym: Phosphoric Acid 2-(1-Methylethyl)phenyl Diphenyl Ester,Diphenyl 2-Isopropylphenyl Phosphate,o-Isopropylphenyl Diphenyl Phosphate; SMILES: O=P(OC=1C=CC=CC1)(OC=2C=CC=CC2)OC=3C=CC=CC3C(C)C

CAS 64532-94-1
Molecular Weight (g/mol) 368.36
SMILES O=P(OC=1C=CC=CC1)(OC=2C=CC=CC2)OC=3C=CC=CC3C(C)C
Synonym Phosphoric Acid 2-(1-Methylethyl)phenyl Diphenyl Ester,Diphenyl 2-Isopropylphenyl Phosphate,o-Isopropylphenyl Diphenyl Phosphate;
Molecular Formula C21H21O4P