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Organic acids and derivatives

Organic compounds with acidic properties, and will commonly have carboxylic acids or similar functional groups in their structure. Derived compounds are also included.
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1-Heptanesulfonic Acid Sodium Salt (HPLC), Fisher Chemical™

CAS: 22767-50-6 Molecular Formula: C7H15NaO3S MDL Number: MFCD00007543 InChI Key: REFMEZARFCPESH-UHFFFAOYSA-M PubChem CID: 23672332

EDGE
PubChem CID 23672332
CAS 22767-50-6
MDL Number MFCD00007543
InChI Key REFMEZARFCPESH-UHFFFAOYSA-M
Molecular Formula C7H15NaO3S
2
Promotions Available

1-Hexanesulfonic Acid Sodium Salt (HPLC), Fisher Chemical™
GSA_VA

CAS: 2832-45-3 Molecular Formula: C6H13NaO3S Molecular Weight (g/mol): 188.22 MDL Number: MFCD00007542 InChI Key: QWSZRRAAFHGKCH-UHFFFAOYSA-M PubChem CID: 23677630 IUPAC Name: sodium hexane-1-sulfonate SMILES: [Na+].CCCCCCS([O-])(=O)=O

EDGE
PubChem CID 23677630
CAS 2832-45-3
Molecular Weight (g/mol) 188.22
MDL Number MFCD00007542
SMILES [Na+].CCCCCCS([O-])(=O)=O
IUPAC Name sodium hexane-1-sulfonate
InChI Key QWSZRRAAFHGKCH-UHFFFAOYSA-M
Molecular Formula C6H13NaO3S
3

1-Pentanesulfonic acid, sodium salt, 98+%

CAS: 22767-49-3 Molecular Formula: C5H11NaO3S Molecular Weight (g/mol): 174.19 MDL Number: MFCD00007541,MFCD00149548 InChI Key: ROBLTDOHDSGGDT-UHFFFAOYSA-M Synonym: sodium 1-pentanesulfonate,sodium pentane-1-sulfonate,sodium pentanesulfonate,1-pentanesulfonic acid sodium salt,1-pentanesulfonic acid, sodium salt,1-pentylsodiumsulfonate,ipc-alks-5,1-pentanesulfonate, sodium,pentanesulfonic acid na-salt,pentanesulfonic acidsodiumsalt PubChem CID: 23664617 IUPAC Name: sodium;pentane-1-sulfonate SMILES: [Na+].CCCCCS([O-])(=O)=O

PubChem CID 23664617
CAS 22767-49-3
Molecular Weight (g/mol) 174.19
MDL Number MFCD00007541,MFCD00149548
SMILES [Na+].CCCCCS([O-])(=O)=O
Synonym sodium 1-pentanesulfonate,sodium pentane-1-sulfonate,sodium pentanesulfonate,1-pentanesulfonic acid sodium salt,1-pentanesulfonic acid, sodium salt,1-pentylsodiumsulfonate,ipc-alks-5,1-pentanesulfonate, sodium,pentanesulfonic acid na-salt,pentanesulfonic acidsodiumsalt
IUPAC Name sodium;pentane-1-sulfonate
InChI Key ROBLTDOHDSGGDT-UHFFFAOYSA-M
Molecular Formula C5H11NaO3S
4

Sodium 1-octanesulfonate, 99%

CAS: 5324-84-5 Molecular Formula: C8H17NaO3S Molecular Weight (g/mol): 216.27 MDL Number: MFCD00007544 InChI Key: HRQDCDQDOPSGBR-UHFFFAOYSA-M Synonym: sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8 PubChem CID: 23669624 IUPAC Name: sodium;octane-1-sulfonate SMILES: [Na+].CCCCCCCCS([O-])(=O)=O

PubChem CID 23669624
CAS 5324-84-5
Molecular Weight (g/mol) 216.27
MDL Number MFCD00007544
SMILES [Na+].CCCCCCCCS([O-])(=O)=O
Synonym sodium 1-octanesulfonate,sodium octane-1-sulfonate,1-octanesulfonic acid sodium salt,sodium octanesulfonate,1-octanesulfonic acid, sodium salt,1-octanesulfonate, sodium,sodium octylsulfonate,unii-j46ez5jyb3,octyl sodium sulfonate,ipc-alks-8
IUPAC Name sodium;octane-1-sulfonate
InChI Key HRQDCDQDOPSGBR-UHFFFAOYSA-M
Molecular Formula C8H17NaO3S
5

Sodium 1-Hexanesulfonate Monohydrate, 99%

CAS: 207300-91-2 Molecular Formula: C6H15NaO4S Molecular Weight (g/mol): 206.232 MDL Number: MFCD00149549 InChI Key: CLCGFJYKZGFGSQ-UHFFFAOYSA-M Synonym: 1-hexanesulfonic acid sodium salt monohydrate,sodium hexane-1-sulfonate hydrate,sodium 1-hexanesulfonate monohydrate,n-1-hexanesulfonic acid,sodium 1-hexanesulfonate hydrate,sodium n-hexanesulfonate monohydrate,potassium hexane-1-sulfonate hydrate,sodium hexane-1-sulphonate monohydrate,sodium hexane-1-sulfonate-water 1/1/1,1-hexanesulfonic acid,sodium salt, hydrate 1:1:1 PubChem CID: 23696962 IUPAC Name: sodium;hexane-1-sulfonate;hydrate SMILES: CCCCCCS(=O)(=O)[O-].O.[Na+]

PubChem CID 23696962
CAS 207300-91-2
Molecular Weight (g/mol) 206.232
MDL Number MFCD00149549
SMILES CCCCCCS(=O)(=O)[O-].O.[Na+]
Synonym 1-hexanesulfonic acid sodium salt monohydrate,sodium hexane-1-sulfonate hydrate,sodium 1-hexanesulfonate monohydrate,n-1-hexanesulfonic acid,sodium 1-hexanesulfonate hydrate,sodium n-hexanesulfonate monohydrate,potassium hexane-1-sulfonate hydrate,sodium hexane-1-sulphonate monohydrate,sodium hexane-1-sulfonate-water 1/1/1,1-hexanesulfonic acid,sodium salt, hydrate 1:1:1
IUPAC Name sodium;hexane-1-sulfonate;hydrate
InChI Key CLCGFJYKZGFGSQ-UHFFFAOYSA-M
Molecular Formula C6H15NaO4S
6

Sodium 1-hexanesulfonate, 99%

CAS: 2832-45-3 Molecular Formula: C6H13NaO3S Molecular Weight (g/mol): 188.22 MDL Number: MFCD00007542 InChI Key: QWSZRRAAFHGKCH-UHFFFAOYSA-M Synonym: sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt PubChem CID: 23677630 IUPAC Name: sodium;hexane-1-sulfonate SMILES: [Na+].CCCCCCS([O-])(=O)=O

PubChem CID 23677630
CAS 2832-45-3
Molecular Weight (g/mol) 188.22
MDL Number MFCD00007542
SMILES [Na+].CCCCCCS([O-])(=O)=O
Synonym sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt
IUPAC Name sodium;hexane-1-sulfonate
InChI Key QWSZRRAAFHGKCH-UHFFFAOYSA-M
Molecular Formula C6H13NaO3S
7

1-Cyclohexene-1-acetic acid

CAS: 18294-87-6 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD00015482 InChI Key: KDFBPHXESBPHTK-UHFFFAOYSA-N Synonym: 1-cyclohexenylacetic acid,1-cyclohexene-1-acetic acid,2-cyclohex-1-en-1-yl acetic acid,cyclohex-1-enylacetic acid,1-cyclohexene-1-aceticacid,2-cyclohexen-1-yl acetic acid,2-cyclohex-1-enylacetic acid,cyclohex-1-en-1-ylacetic acid,1-cyclohexenylacetate,cyclohexenylacetic acid PubChem CID: 86699 IUPAC Name: 2-(cyclohexen-1-yl)acetic acid SMILES: C1CCC(=CC1)CC(=O)O

PubChem CID 86699
CAS 18294-87-6
Molecular Weight (g/mol) 140.182
MDL Number MFCD00015482
SMILES C1CCC(=CC1)CC(=O)O
Synonym 1-cyclohexenylacetic acid,1-cyclohexene-1-acetic acid,2-cyclohex-1-en-1-yl acetic acid,cyclohex-1-enylacetic acid,1-cyclohexene-1-aceticacid,2-cyclohexen-1-yl acetic acid,2-cyclohex-1-enylacetic acid,cyclohex-1-en-1-ylacetic acid,1-cyclohexenylacetate,cyclohexenylacetic acid
IUPAC Name 2-(cyclohexen-1-yl)acetic acid
InChI Key KDFBPHXESBPHTK-UHFFFAOYSA-N
Molecular Formula C8H12O2
8

1-Cyano-1-cyclopropanecarboxylic acid, 97%

CAS: 6914-79-0 Molecular Formula: C5H4NO2 Molecular Weight (g/mol): 110.09 MDL Number: MFCD00190651 InChI Key: KSJJMSKNZVXAND-UHFFFAOYSA-M Synonym: 1-cyanocyclopropanecarboxylic acid,1-cyano-1-cyclopropanecarboxylic acid,cyanocyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-cyano,cyclopropane, 4,1-cyanocyclopropane-carboxylic acid,1-cyano-1-cyclopropanecarboxylicacid,1-cyano-cyclo-propanecarboxylic acid,1-cyano-1-cyclopropane carboxylic acid,1-cyano-1-cyclopropane-carboxylic acid PubChem CID: 2733259 IUPAC Name: 1-cyanocyclopropane-1-carboxylic acid SMILES: [O-]C(=O)C1(CC1)C#N

PubChem CID 2733259
CAS 6914-79-0
Molecular Weight (g/mol) 110.09
MDL Number MFCD00190651
SMILES [O-]C(=O)C1(CC1)C#N
Synonym 1-cyanocyclopropanecarboxylic acid,1-cyano-1-cyclopropanecarboxylic acid,cyanocyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-cyano,cyclopropane, 4,1-cyanocyclopropane-carboxylic acid,1-cyano-1-cyclopropanecarboxylicacid,1-cyano-cyclo-propanecarboxylic acid,1-cyano-1-cyclopropane carboxylic acid,1-cyano-1-cyclopropane-carboxylic acid
IUPAC Name 1-cyanocyclopropane-1-carboxylic acid
InChI Key KSJJMSKNZVXAND-UHFFFAOYSA-M
Molecular Formula C5H4NO2
9

1-Cyclohexene-1-carboxylic acid, 97%

CAS: 636-82-8 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.155 MDL Number: MFCD00001545 InChI Key: NMEZJSDUZQOPFE-UHFFFAOYSA-N Synonym: 1-cyclohexene-1-carboxylic acid,1-cyclohexenecarboxylic acid,cyclohex-1-enecarboxylic acid,cyclohexenecarboxylic acid,cyclohex-1-ene-1-carboxylic acid,1-cyclohexenecarboxylicacid,cyclohexenyl carboxylic acid,1-cyclohexene carboxylic acid,acmc-1b731,3,4,5,6-tetrahydrobenzoic acid PubChem CID: 69470 ChEBI: CHEBI:29565 IUPAC Name: cyclohexene-1-carboxylic acid SMILES: C1CCC(=CC1)C(=O)O

PubChem CID 69470
CAS 636-82-8
Molecular Weight (g/mol) 126.155
ChEBI CHEBI:29565
MDL Number MFCD00001545
SMILES C1CCC(=CC1)C(=O)O
Synonym 1-cyclohexene-1-carboxylic acid,1-cyclohexenecarboxylic acid,cyclohex-1-enecarboxylic acid,cyclohexenecarboxylic acid,cyclohex-1-ene-1-carboxylic acid,1-cyclohexenecarboxylicacid,cyclohexenyl carboxylic acid,1-cyclohexene carboxylic acid,acmc-1b731,3,4,5,6-tetrahydrobenzoic acid
IUPAC Name cyclohexene-1-carboxylic acid
InChI Key NMEZJSDUZQOPFE-UHFFFAOYSA-N
Molecular Formula C7H10O2
10

Methyl 1-cyclopentene-1-carboxylate, 95%

CAS: 25662-28-6 Molecular Formula: C7H10O2 Molecular Weight (g/mol): 126.16 MDL Number: MFCD00239506 InChI Key: VTYCAXIAUKEGBQ-UHFFFAOYSA-N Synonym: methyl 1-cyclopentene-1-carboxylate,methyl cyclopent-1-enecarboxylate,methyl cyclopent-1-ene-1-carboxylate,cyclopentene-1-carboxylic acid methyl ester,methyl 1-cyclopentenecarboxylate,1-cyclopentenecarboxylic acid methyl ester,1-cyclopentene-1-carboxylic acid, methyl ester,methyl1-cyclopentene-1-carboxylate,1-cyclopentene-1-carboxylic acid methyl ester,pubchem2487 PubChem CID: 549129 IUPAC Name: methyl cyclopentene-1-carboxylate SMILES: COC(=O)C1=CCCC1

PubChem CID 549129
CAS 25662-28-6
Molecular Weight (g/mol) 126.16
MDL Number MFCD00239506
SMILES COC(=O)C1=CCCC1
Synonym methyl 1-cyclopentene-1-carboxylate,methyl cyclopent-1-enecarboxylate,methyl cyclopent-1-ene-1-carboxylate,cyclopentene-1-carboxylic acid methyl ester,methyl 1-cyclopentenecarboxylate,1-cyclopentenecarboxylic acid methyl ester,1-cyclopentene-1-carboxylic acid, methyl ester,methyl1-cyclopentene-1-carboxylate,1-cyclopentene-1-carboxylic acid methyl ester,pubchem2487
IUPAC Name methyl cyclopentene-1-carboxylate
InChI Key VTYCAXIAUKEGBQ-UHFFFAOYSA-N
Molecular Formula C7H10O2
11

1-Phenyl-1-cyclohexanecarboxylic acid, 95%

CAS: 1135-67-7 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.27 MDL Number: MFCD00037152 InChI Key: QXXHHHWXFHPNOS-UHFFFAOYSA-N Synonym: 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid PubChem CID: 70817 IUPAC Name: 1-phenylcyclohexane-1-carboxylic acid SMILES: C1CCC(CC1)(C2=CC=CC=C2)C(=O)O

PubChem CID 70817
CAS 1135-67-7
Molecular Weight (g/mol) 204.27
MDL Number MFCD00037152
SMILES C1CCC(CC1)(C2=CC=CC=C2)C(=O)O
Synonym 1-phenylcyclohexanecarboxylic acid,1-phenyl-1-cyclohexanecarboxylic acid,1-phenyl-cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 1-phenyl,acmc-1c6ij,1-phenylcyclohexanecarboxylicacid,qxxhhhwxfhpnos-uhfffaoysa,1-phenylcyclohexanecarboxylic acid #,cyclohexanecarboxylicacid, 1-phenyl,1-phenyl-1-cyclohexane carboxylic acid
IUPAC Name 1-phenylcyclohexane-1-carboxylic acid
InChI Key QXXHHHWXFHPNOS-UHFFFAOYSA-N
Molecular Formula C13H16O2
12

Methyl 1-cyclohexene-1-carboxylate, 98%

CAS: 18448-47-0 MDL Number: MFCD00001544 InChI Key: KXPWRCPEMHIZGU-UHFFFAOYSA-N Synonym: methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene PubChem CID: 87647 IUPAC Name: methyl cyclohexene-1-carboxylate SMILES: COC(=O)C1=CCCCC1

PubChem CID 87647
CAS 18448-47-0
MDL Number MFCD00001544
SMILES COC(=O)C1=CCCCC1
Synonym methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene
IUPAC Name methyl cyclohexene-1-carboxylate
InChI Key KXPWRCPEMHIZGU-UHFFFAOYSA-N
13

1-Phenyl-1-cyclopropanecarboxylic acid, 97%

CAS: 6120-95-2 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00001288 InChI Key: IWWCCNVRNHTGLV-UHFFFAOYSA-N Synonym: 1-phenylcyclopropanecarboxylic acid,1-phenyl-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-phenyl,1-phenyl-cyclopropanecarboxylic acid,1-phenyl-1-cyclopropanecarboxylicacid,pubchem15554,acmc-1b2kn,phenylcyclopropanecarboxylic acid,1-phenyl-cyclopropanecarboxlic acid,1-phenylcyclo-propanecarboxylic acid PubChem CID: 80206 IUPAC Name: 1-phenylcyclopropane-1-carboxylic acid SMILES: C1CC1(C2=CC=CC=C2)C(=O)O

PubChem CID 80206
CAS 6120-95-2
Molecular Weight (g/mol) 162.19
MDL Number MFCD00001288
SMILES C1CC1(C2=CC=CC=C2)C(=O)O
Synonym 1-phenylcyclopropanecarboxylic acid,1-phenyl-1-cyclopropanecarboxylic acid,cyclopropanecarboxylic acid, 1-phenyl,1-phenyl-cyclopropanecarboxylic acid,1-phenyl-1-cyclopropanecarboxylicacid,pubchem15554,acmc-1b2kn,phenylcyclopropanecarboxylic acid,1-phenyl-cyclopropanecarboxlic acid,1-phenylcyclo-propanecarboxylic acid
IUPAC Name 1-phenylcyclopropane-1-carboxylic acid
InChI Key IWWCCNVRNHTGLV-UHFFFAOYSA-N
Molecular Formula C10H10O2
14

Methyl 1-cyclohexene-1-carboxylate, 97%

CAS: 18448-47-0 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD00001544 InChI Key: KXPWRCPEMHIZGU-UHFFFAOYSA-N Synonym: methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene PubChem CID: 87647 IUPAC Name: methyl cyclohexene-1-carboxylate SMILES: COC(=O)C1=CCCCC1

PubChem CID 87647
CAS 18448-47-0
Molecular Weight (g/mol) 140.182
MDL Number MFCD00001544
SMILES COC(=O)C1=CCCCC1
Synonym methyl 1-cyclohexene-1-carboxylate,methyl cyclohex-1-enecarboxylate,methyl 1-cyclohexenecarboxylate,methyl cyclohex-1-ene-1-carboxylate,1-cyclohexene-1-carboxylic acid, methyl ester,cyclohexenecarboxylic acid, methyl ester,cyclohexene-1-carboxylic acid methyl ester,methyl1-cyclohexene-1-carboxylate,pubchem11031,1-carbomethoxy cyclohexene
IUPAC Name methyl cyclohexene-1-carboxylate
InChI Key KXPWRCPEMHIZGU-UHFFFAOYSA-N
Molecular Formula C8H12O2
15

Methyl 1-hydroxy-1-cyclopropane carboxylate, 90%

CAS: 33689-29-1 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD02093884 InChI Key: KPJWVJURYXOHOO-UHFFFAOYSA-N Synonym: methyl 1-hydroxycyclopropanecarboxylate,methyl 1-hydroxy-1-cyclopropane carboxylate,methyl 1-hydroxy-1-cyclopropanecarboxylate,1-hydroxycyclopropanecarboxylic acid methyl ester,1-hydroxy-cyclopropanecarboxylic acid methyl ester,methyl-1-hydroxy-1-cyclopropane carboxylate,hydroxy-cyclopropanecarboxylic acid methyl ester,1-hydroxy-cyclopropane-1-carboxylic acid methyl ester,cyclopropanecarboxylic acid, 1-hydroxy-, methyl ester PubChem CID: 2733178 IUPAC Name: methyl 1-hydroxycyclopropane-1-carboxylate SMILES: COC(=O)C1(O)CC1

PubChem CID 2733178
CAS 33689-29-1
Molecular Weight (g/mol) 116.12
MDL Number MFCD02093884
SMILES COC(=O)C1(O)CC1
Synonym methyl 1-hydroxycyclopropanecarboxylate,methyl 1-hydroxy-1-cyclopropane carboxylate,methyl 1-hydroxy-1-cyclopropanecarboxylate,1-hydroxycyclopropanecarboxylic acid methyl ester,1-hydroxy-cyclopropanecarboxylic acid methyl ester,methyl-1-hydroxy-1-cyclopropane carboxylate,hydroxy-cyclopropanecarboxylic acid methyl ester,1-hydroxy-cyclopropane-1-carboxylic acid methyl ester,cyclopropanecarboxylic acid, 1-hydroxy-, methyl ester
IUPAC Name methyl 1-hydroxycyclopropane-1-carboxylate
InChI Key KPJWVJURYXOHOO-UHFFFAOYSA-N
Molecular Formula C5H8O3