Organic acids and derivatives
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Vinyl decanoate, 95%, stab.
CAS: 4704-31-8 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00027349 InChI Key: CMDXMIHZUJPRHG-UHFFFAOYSA-N Synonym: vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate PubChem CID: 62140 IUPAC Name: ethenyl decanoate SMILES: CCCCCCCCCC(=O)OC=C
| PubChem CID | 62140 |
|---|---|
| CAS | 4704-31-8 |
| Molecular Weight (g/mol) | 198.306 |
| MDL Number | MFCD00027349 |
| SMILES | CCCCCCCCCC(=O)OC=C |
| Synonym | vinyl decanoate,decanoic acid, vinyl ester,vinyl n-decanoate,unii-ff00i399li,decanoic acid, ethenyl ester,n-capric acid vinyl ester,decanoic acid vinyl,acmc-1aqz4,decanoic acid vinyl ester,capric acid vinyl ester = vinyl decenoate |
| IUPAC Name | ethenyl decanoate |
| InChI Key | CMDXMIHZUJPRHG-UHFFFAOYSA-N |
| Molecular Formula | C12H22O2 |
4,4,5,5-Tetramethyl-2-(2-methyl-3-furyl)-1,3,2-dioxaborolane, 90%
CAS: 864776-02-3 Molecular Formula: C11H17BO3 Molecular Weight (g/mol): 208.06 MDL Number: MFCD09879905 InChI Key: JMLBPHNESOKSEV-UHFFFAOYSA-N Synonym: 4,4,5,5-tetramethyl-2-2-methylfuran-3-yl-1,3,2-dioxaborolane,2-methylfuran-3-boronic acid, pinacol ester,4,4,5,5-tetramethyl-2-2-methyl-3-furanyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-2-methyl-3-furanyl,4,4,5,5-tetramethyl-2-2-methyl-3-furyl-1,3,2-dioxaborolane,pubchem18438,2-2-methylfur-3-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-methyl-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl furan,4,4,5,5-tetramethyl-2-2-methyl 3-furyl-1,3,2-dioxaborolane,3-hydroxy-2,3-dimethylbutan-2-yl hydrogen 2-methylfuran-3-yl boronate PubChem CID: 24229547 IUPAC Name: 4,4,5,5-tetramethyl-2-(2-methylfuran-3-yl)-1,3,2-dioxaborolane SMILES: CC1=C(C=CO1)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 24229547 |
|---|---|
| CAS | 864776-02-3 |
| Molecular Weight (g/mol) | 208.06 |
| MDL Number | MFCD09879905 |
| SMILES | CC1=C(C=CO1)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 4,4,5,5-tetramethyl-2-2-methylfuran-3-yl-1,3,2-dioxaborolane,2-methylfuran-3-boronic acid, pinacol ester,4,4,5,5-tetramethyl-2-2-methyl-3-furanyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane,4,4,5,5-tetramethyl-2-2-methyl-3-furanyl,4,4,5,5-tetramethyl-2-2-methyl-3-furyl-1,3,2-dioxaborolane,pubchem18438,2-2-methylfur-3-yl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-methyl-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl furan,4,4,5,5-tetramethyl-2-2-methyl 3-furyl-1,3,2-dioxaborolane,3-hydroxy-2,3-dimethylbutan-2-yl hydrogen 2-methylfuran-3-yl boronate |
| IUPAC Name | 4,4,5,5-tetramethyl-2-(2-methylfuran-3-yl)-1,3,2-dioxaborolane |
| InChI Key | JMLBPHNESOKSEV-UHFFFAOYSA-N |
| Molecular Formula | C11H17BO3 |
Hydroxylamine-O-sulfonic acid, 97%
CAS: 2950-43-8 Molecular Formula: H3NO4S Molecular Weight (g/mol): 113.09 MDL Number: MFCD00011604 InChI Key: DQPBABKTKYNPMH-UHFFFAOYSA-N Synonym: hydroxylamine-o-sulfonic acid,aminooxy sulfonic acid,sulfoperamidic acid,hydroxylamine-o-sulphonic acid,permonosulfamic acid,amidoperoxymonosulfuric acid,aminooxysulfonic acid,amidosulfonic peracid,haos,sulfamic acid n-oxide PubChem CID: 76284 IUPAC Name: amino hydrogen sulfate SMILES: NOS(O)(=O)=O
| PubChem CID | 76284 |
|---|---|
| CAS | 2950-43-8 |
| Molecular Weight (g/mol) | 113.09 |
| MDL Number | MFCD00011604 |
| SMILES | NOS(O)(=O)=O |
| Synonym | hydroxylamine-o-sulfonic acid,aminooxy sulfonic acid,sulfoperamidic acid,hydroxylamine-o-sulphonic acid,permonosulfamic acid,amidoperoxymonosulfuric acid,aminooxysulfonic acid,amidosulfonic peracid,haos,sulfamic acid n-oxide |
| IUPAC Name | amino hydrogen sulfate |
| InChI Key | DQPBABKTKYNPMH-UHFFFAOYSA-N |
| Molecular Formula | H3NO4S |
Ethanesulfonic acid sodium salt, 98%, may cont. ca 2% water
CAS: 5324-47-0 Molecular Formula: C2H5NaO3S Molecular Weight (g/mol): 132.109 MDL Number: MFCD00066498 InChI Key: KQFAFFYKLIBKDE-UHFFFAOYSA-M Synonym: sodium ethanesulfonate,sodium ethanesulphonate,ethanesulfonic acid sodium salt,ethanesulfonic acid, sodium salt,ethane sulfonic acid sodium salt,sodiumethanesulfonate,sodium ethylsulfonate,sodium esylate,sodium ethane sulfonate,ethylsulfonic acid sodium salt PubChem CID: 4192170 IUPAC Name: sodium;ethanesulfonate SMILES: CCS(=O)(=O)[O-].[Na+]
| PubChem CID | 4192170 |
|---|---|
| CAS | 5324-47-0 |
| Molecular Weight (g/mol) | 132.109 |
| MDL Number | MFCD00066498 |
| SMILES | CCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium ethanesulfonate,sodium ethanesulphonate,ethanesulfonic acid sodium salt,ethanesulfonic acid, sodium salt,ethane sulfonic acid sodium salt,sodiumethanesulfonate,sodium ethylsulfonate,sodium esylate,sodium ethane sulfonate,ethylsulfonic acid sodium salt |
| IUPAC Name | sodium;ethanesulfonate |
| InChI Key | KQFAFFYKLIBKDE-UHFFFAOYSA-M |
| Molecular Formula | C2H5NaO3S |
Fumonisin B1, 96%
CAS: 116355-83-0 Molecular Formula: C34H59NO15 Molecular Weight (g/mol): 721.8 MDL Number: MFCD00133349 InChI Key: UVBUBMSSQKOIBE-UWCNXKJPSA-N Synonym: macrofusine,fumonisin b1,2r,2'r-1,2,3-propanetricarboxylic acid 1,1'-1s,2r-1-2s,4r,9r,11s,12s-12-amino-4,9,11-trihydroxy-2-methyltridecyl-2-1r-1-methylpentyl-1,2-ethanediyl ester,2s-2-2-5r,6r,7s,9s,11r,16r,18s,19s-19-amino-6-3r-3,4-dicarboxybutanoyl oxy-11,16,18-trihydroxy-5,9-dimethylicosan-7-yl oxy-2-oxoethyl butanedioic acid PubChem CID: 16760030 IUPAC Name: (2S)-2-[2-[(5R,6R,7S,9S,11R,16R,18S,19S)-19-amino-6-[(3R)-3,4-dicarboxybutanoyl]oxy-11,16,18-trihydroxy-5,9-dimethylicosan-7-yl]oxy-2-oxoethyl]butanedioic acid SMILES: CCCCC(C)C(C(CC(C)CC(CCCCC(CC(C(C)N)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O
| PubChem CID | 16760030 |
|---|---|
| CAS | 116355-83-0 |
| Molecular Weight (g/mol) | 721.8 |
| MDL Number | MFCD00133349 |
| SMILES | CCCCC(C)C(C(CC(C)CC(CCCCC(CC(C(C)N)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O |
| Synonym | macrofusine,fumonisin b1,2r,2'r-1,2,3-propanetricarboxylic acid 1,1'-1s,2r-1-2s,4r,9r,11s,12s-12-amino-4,9,11-trihydroxy-2-methyltridecyl-2-1r-1-methylpentyl-1,2-ethanediyl ester,2s-2-2-5r,6r,7s,9s,11r,16r,18s,19s-19-amino-6-3r-3,4-dicarboxybutanoyl oxy-11,16,18-trihydroxy-5,9-dimethylicosan-7-yl oxy-2-oxoethyl butanedioic acid |
| IUPAC Name | (2S)-2-[2-[(5R,6R,7S,9S,11R,16R,18S,19S)-19-amino-6-[(3R)-3,4-dicarboxybutanoyl]oxy-11,16,18-trihydroxy-5,9-dimethylicosan-7-yl]oxy-2-oxoethyl]butanedioic acid |
| InChI Key | UVBUBMSSQKOIBE-UWCNXKJPSA-N |
| Molecular Formula | C34H59NO15 |
Bismuth(III) trifluoromethanesulfonate, 99%
CAS: 88189-03-1 Molecular Formula: C3BiF9O9S3 Molecular Weight (g/mol): 656.17 MDL Number: MFCD02093669 InChI Key: NYENCOMLZDQKNH-UHFFFAOYSA-K Synonym: bismuth iii trifluoromethanesulfonate,bismuth triflate,bismuth trifluoromethanesulfonate,bismuth 3+ triflate,bismuth triflate mi,bismuth 3+ trifluoromethanesulfonate,bismuth tris trifluoromethanesulfonate,bismuth iii triflate,bismuth 3+ ion tritriflate PubChem CID: 9917655 IUPAC Name: bismuth;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Bi+3]
| PubChem CID | 9917655 |
|---|---|
| CAS | 88189-03-1 |
| Molecular Weight (g/mol) | 656.17 |
| MDL Number | MFCD02093669 |
| SMILES | C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Bi+3] |
| Synonym | bismuth iii trifluoromethanesulfonate,bismuth triflate,bismuth trifluoromethanesulfonate,bismuth 3+ triflate,bismuth triflate mi,bismuth 3+ trifluoromethanesulfonate,bismuth tris trifluoromethanesulfonate,bismuth iii triflate,bismuth 3+ ion tritriflate |
| IUPAC Name | bismuth;trifluoromethanesulfonate |
| InChI Key | NYENCOMLZDQKNH-UHFFFAOYSA-K |
| Molecular Formula | C3BiF9O9S3 |
2-(3-Bromopropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 97%
CAS: 124215-44-7 Molecular Formula: C9H18BBrO2 Molecular Weight (g/mol): 248.96 MDL Number: MFCD10567053 InChI Key: CHQXFJUKMDJWHO-UHFFFAOYSA-N Synonym: 2-3-bromopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,3-bromopropylboronic acid pinacol ester,1,3,2-dioxaborolane,2-3-bromopropyl-4,4,5,5-tetramethyl,acmc-1c5j4,3-bromopropylboronic acid, pinacol ester,2-3-bromopropyl-4?4?5?5-tetramethyl-1?3?2-dioxaborolane PubChem CID: 14836669 IUPAC Name: 2-(3-bromopropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(CCCBr)OC1(C)C
| PubChem CID | 14836669 |
|---|---|
| CAS | 124215-44-7 |
| Molecular Weight (g/mol) | 248.96 |
| MDL Number | MFCD10567053 |
| SMILES | CC1(C)OB(CCCBr)OC1(C)C |
| Synonym | 2-3-bromopropyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,3-bromopropylboronic acid pinacol ester,1,3,2-dioxaborolane,2-3-bromopropyl-4,4,5,5-tetramethyl,acmc-1c5j4,3-bromopropylboronic acid, pinacol ester,2-3-bromopropyl-4?4?5?5-tetramethyl-1?3?2-dioxaborolane |
| IUPAC Name | 2-(3-bromopropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | CHQXFJUKMDJWHO-UHFFFAOYSA-N |
| Molecular Formula | C9H18BBrO2 |
(4S)-N-Crotonyl-4-isopropyl-2-oxazolidinone, 99%, Thermo Scientific™
CAS: 90719-29-2 Molecular Formula: C10H15NO3 Molecular Weight (g/mol): 197.23 MDL Number: MFCD00075429 InChI Key: YZRHIMNEVFYTAJ-WTSVBCDHSA-N Synonym: 4s-3-2e-but-2-enoyl-4-isopropyl-1,3-oxazolidin-2-one,hg^l@lanry gyifjffjamdp,4s-n-crotonyl-4-isopropyl-2-oxazolidinone,3-2-butenoyl-4beta-isopropyloxazolidine-2-one,4s-3-crotonoyl-4beta-isopropyloxazolidine-2-one,s-+-3-crotonoyl-4-isopropyl-2-oxazolidinone,4s-3-e-but-2-enoyl-4-propan-2-yl-1,3-oxazolidin-2-one,3-trans-3-methyl-2-propenoyl-4-s-isopropyl-2-oxazolidinone PubChem CID: 5702601 IUPAC Name: (4S)-3-[(E)-but-2-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one SMILES: CC=CC(=O)N1C(COC1=O)C(C)C
| PubChem CID | 5702601 |
|---|---|
| CAS | 90719-29-2 |
| Molecular Weight (g/mol) | 197.23 |
| MDL Number | MFCD00075429 |
| SMILES | CC=CC(=O)N1C(COC1=O)C(C)C |
| Synonym | 4s-3-2e-but-2-enoyl-4-isopropyl-1,3-oxazolidin-2-one,hg^l@lanry gyifjffjamdp,4s-n-crotonyl-4-isopropyl-2-oxazolidinone,3-2-butenoyl-4beta-isopropyloxazolidine-2-one,4s-3-crotonoyl-4beta-isopropyloxazolidine-2-one,s-+-3-crotonoyl-4-isopropyl-2-oxazolidinone,4s-3-e-but-2-enoyl-4-propan-2-yl-1,3-oxazolidin-2-one,3-trans-3-methyl-2-propenoyl-4-s-isopropyl-2-oxazolidinone |
| IUPAC Name | (4S)-3-[(E)-but-2-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one |
| InChI Key | YZRHIMNEVFYTAJ-WTSVBCDHSA-N |
| Molecular Formula | C10H15NO3 |
Naproxen Sodium, USP, 98-102%, Spectrum™ Chemical
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CAS: 26159-34-2 Molecular Formula: C14H13NaO3 Molecular Weight (g/mol): 252.25 MDL Number: MFCD00058507 InChI Key: CDBRNDSHEYLDJV-FVGYRXGTSA-M IUPAC Name: sodium (2S)-2-(6-methoxynaphthalen-2-yl)propanoate SMILES: [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O
| CAS | 26159-34-2 |
|---|---|
| Molecular Weight (g/mol) | 252.25 |
| MDL Number | MFCD00058507 |
| SMILES | [Na+].COC1=CC=C2C=C(C=CC2=C1)[C@H](C)C([O-])=O |
| IUPAC Name | sodium (2S)-2-(6-methoxynaphthalen-2-yl)propanoate |
| InChI Key | CDBRNDSHEYLDJV-FVGYRXGTSA-M |
| Molecular Formula | C14H13NaO3 |
1-Propanesulfonic acid, 95%
CAS: 5284-66-2 Molecular Formula: C3H8O3S Molecular Weight (g/mol): 124.16 MDL Number: MFCD00041889 InChI Key: KCXFHTAICRTXLI-UHFFFAOYSA-N Synonym: 1-propanesulfonic acid,propanesulfonic acid,propylsulfonic acid,propanesulfonate,propanesulphonic acid,ammonium propanesulfonate,propane-1-sulphonic acid,ncistruc1_001874,ncistruc2_000257,1-propanesulfonic acid, technical t PubChem CID: 78938 IUPAC Name: propane-1-sulfonic acid SMILES: CCCS(=O)(=O)O
| PubChem CID | 78938 |
|---|---|
| CAS | 5284-66-2 |
| Molecular Weight (g/mol) | 124.16 |
| MDL Number | MFCD00041889 |
| SMILES | CCCS(=O)(=O)O |
| Synonym | 1-propanesulfonic acid,propanesulfonic acid,propylsulfonic acid,propanesulfonate,propanesulphonic acid,ammonium propanesulfonate,propane-1-sulphonic acid,ncistruc1_001874,ncistruc2_000257,1-propanesulfonic acid, technical t |
| IUPAC Name | propane-1-sulfonic acid |
| InChI Key | KCXFHTAICRTXLI-UHFFFAOYSA-N |
| Molecular Formula | C3H8O3S |
L-Dihydroorotic acid, 99%
CAS: 5988-19-2 Molecular Formula: C5H6N2O4 Molecular Weight (g/mol): 158.11 InChI Key: UFIVEPVSAGBUSI-REOHCLBHSA-N Synonym: l-dihydroorotic acid,s-2,6-dioxohexahydropyrimidine-4-carboxylic acid,l-dihydroorotate,dihydro-l-orotic acid,s-dihydroorotic acid,l-hydroorotic acid,s-dihydroorotate,hydroorotic acid, l,4s-2,6-dioxo-1,3-diazinane-4-carboxylic acid,s-4,5-dihydroorotate PubChem CID: 439216 ChEBI: CHEBI:17025 IUPAC Name: (4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acid SMILES: C1C(NC(=O)NC1=O)C(=O)O
| PubChem CID | 439216 |
|---|---|
| CAS | 5988-19-2 |
| Molecular Weight (g/mol) | 158.11 |
| ChEBI | CHEBI:17025 |
| SMILES | C1C(NC(=O)NC1=O)C(=O)O |
| Synonym | l-dihydroorotic acid,s-2,6-dioxohexahydropyrimidine-4-carboxylic acid,l-dihydroorotate,dihydro-l-orotic acid,s-dihydroorotic acid,l-hydroorotic acid,s-dihydroorotate,hydroorotic acid, l,4s-2,6-dioxo-1,3-diazinane-4-carboxylic acid,s-4,5-dihydroorotate |
| IUPAC Name | (4S)-2,6-dioxo-1,3-diazinane-4-carboxylic acid |
| InChI Key | UFIVEPVSAGBUSI-REOHCLBHSA-N |
| Molecular Formula | C5H6N2O4 |
4-(Cyanomethoxy)phenylboronic acid, 97%, Thermo Scientific Chemicals
CAS: 947533-23-5 Molecular Formula: C8H8BNO3 Molecular Weight (g/mol): 176.97 MDL Number: MFCD09908170 InChI Key: GKJPNYHKHSLHCC-UHFFFAOYSA-N Synonym: 4-cyanomethoxyphenylboronic acid,4-cyanomethoxy phenyl boronic acid,4-cyanomethoxy phenylboronic acid,acmc-209rtj PubChem CID: 21918429 IUPAC Name: [4-(cyanomethoxy)phenyl]boronic acid SMILES: OB(O)C1=CC=C(OCC#N)C=C1
| PubChem CID | 21918429 |
|---|---|
| CAS | 947533-23-5 |
| Molecular Weight (g/mol) | 176.97 |
| MDL Number | MFCD09908170 |
| SMILES | OB(O)C1=CC=C(OCC#N)C=C1 |
| Synonym | 4-cyanomethoxyphenylboronic acid,4-cyanomethoxy phenyl boronic acid,4-cyanomethoxy phenylboronic acid,acmc-209rtj |
| IUPAC Name | [4-(cyanomethoxy)phenyl]boronic acid |
| InChI Key | GKJPNYHKHSLHCC-UHFFFAOYSA-N |
| Molecular Formula | C8H8BNO3 |
4-Amino-3-hydroxy-1-naphthalene Sulfonic Acid, ACS, 90%, Spectrum™ Chemical
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CAS: 116-63-2 Molecular Formula: C10H9NO4S Molecular Weight (g/mol): 239.25 InChI Key: RXCMFQDTWCCLBL-UHFFFAOYSA-N IUPAC Name: 4-amino-3-hydroxynaphthalene-1-sulfonic acid SMILES: NC1=C2C=CC=CC2=C(C=C1O)S(O)(=O)=O
| CAS | 116-63-2 |
|---|---|
| Molecular Weight (g/mol) | 239.25 |
| SMILES | NC1=C2C=CC=CC2=C(C=C1O)S(O)(=O)=O |
| IUPAC Name | 4-amino-3-hydroxynaphthalene-1-sulfonic acid |
| InChI Key | RXCMFQDTWCCLBL-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO4S |
1-Heptanesulfonic Acid Sodium Salt, Spectrum™ Chemical
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CAS: 207300-90-1
| CAS | 207300-90-1 |
|---|
Benzenesulfonic acid, sodium salt, 98%
CAS: 515-42-4 Molecular Formula: C6H5NaO3S Molecular Weight (g/mol): 180.16 MDL Number: MFCD00065179 InChI Key: MZSDGDXXBZSFTG-UHFFFAOYSA-M Synonym: sodium benzenesulfonate,benzenesulfonic acid sodium salt,benzenesulfonic acid, sodium salt,dispersant gn,sodium phenylsulfonate,sodium benzenesulphonate,sodium benzene sulfonate,sodium benzene monosulfate,unii-k5rm14azhx,sodium benzene monosulfonate PubChem CID: 517327 IUPAC Name: sodium;benzenesulfonate SMILES: C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]
| PubChem CID | 517327 |
|---|---|
| CAS | 515-42-4 |
| Molecular Weight (g/mol) | 180.16 |
| MDL Number | MFCD00065179 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+] |
| Synonym | sodium benzenesulfonate,benzenesulfonic acid sodium salt,benzenesulfonic acid, sodium salt,dispersant gn,sodium phenylsulfonate,sodium benzenesulphonate,sodium benzene sulfonate,sodium benzene monosulfate,unii-k5rm14azhx,sodium benzene monosulfonate |
| IUPAC Name | sodium;benzenesulfonate |
| InChI Key | MZSDGDXXBZSFTG-UHFFFAOYSA-M |
| Molecular Formula | C6H5NaO3S |