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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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631 – 645 of 16,398 results
631

Allyl trifluoroacetate, 97%

CAS: 383-67-5 Molecular Formula: C5H5F3O2 Molecular Weight (g/mol): 154.088 MDL Number: MFCD00013567 InChI Key: XIVPVSIDXBTZLM-UHFFFAOYSA-N Synonym: allyl trifluoroacetate,allyl trifluoracetate,trifluoroacetic acid allyl ester,prop-2-en-1-yl 2,2,2-trifluoroacetate,allyltrifluoroacetate,pubchem12548,acmc-209izu,allyl alcohol, trifluoroacetate,acetic acid, trifluoro-, allyl ester PubChem CID: 67845 IUPAC Name: prop-2-enyl 2,2,2-trifluoroacetate SMILES: C=CCOC(=O)C(F)(F)F

PubChem CID 67845
CAS 383-67-5
Molecular Weight (g/mol) 154.088
MDL Number MFCD00013567
SMILES C=CCOC(=O)C(F)(F)F
Synonym allyl trifluoroacetate,allyl trifluoracetate,trifluoroacetic acid allyl ester,prop-2-en-1-yl 2,2,2-trifluoroacetate,allyltrifluoroacetate,pubchem12548,acmc-209izu,allyl alcohol, trifluoroacetate,acetic acid, trifluoro-, allyl ester
IUPAC Name prop-2-enyl 2,2,2-trifluoroacetate
InChI Key XIVPVSIDXBTZLM-UHFFFAOYSA-N
Molecular Formula C5H5F3O2
632

Allyl chloroacetate, 98%

CAS: 2916-14-5 Molecular Formula: C5H7ClO2 Molecular Weight (g/mol): 134.559 MDL Number: MFCD00058936 InChI Key: VMBJJCDVORDOCF-UHFFFAOYSA-N Synonym: allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester PubChem CID: 76206 IUPAC Name: prop-2-enyl 2-chloroacetate SMILES: C=CCOC(=O)CCl

PubChem CID 76206
CAS 2916-14-5
Molecular Weight (g/mol) 134.559
MDL Number MFCD00058936
SMILES C=CCOC(=O)CCl
Synonym allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester
IUPAC Name prop-2-enyl 2-chloroacetate
InChI Key VMBJJCDVORDOCF-UHFFFAOYSA-N
Molecular Formula C5H7ClO2
633

Sodium Citrate ACS AR Crystal, Macron Fine Chemicals™

CAS: 4-3-6132 Molecular Formula: C6H9Na3O9 Molecular Weight (g/mol): 294.10 InChI Key: NLJMYIDDQXHKNR-UHFFFAOYSA-K Synonym: trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate PubChem CID: 71474 ChEBI: CHEBI:32142 IUPAC Name: trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+]

PubChem CID 71474
CAS 4-3-6132
Molecular Weight (g/mol) 294.10
ChEBI CHEBI:32142
SMILES C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+]
Synonym trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate
IUPAC Name trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate
InChI Key NLJMYIDDQXHKNR-UHFFFAOYSA-K
Molecular Formula C6H9Na3O9
634

Sodium dihydrogen citrate, 99%

CAS: 18996-35-5 Molecular Formula: C6H10NaO7 Molecular Weight (g/mol): 217.129 MDL Number: MFCD00013067 InChI Key: SLWOXBQHKZPUNY-UHFFFAOYSA-N Synonym: bicitra,pneucid,1,2,3-propanetricarboxylic acid, 2-hydroxy-, sodium salt,sodium dihydrogen citrate anhydrous,citric acid, sodium salt,citric acid sodium,sodium 2-hydroxy-1,2,3-propanetricarboxylate,2-hydroxypropane-1,2,3-tricarboxylic acid; sodium,1,2,3-propanetricarboxylic acid, 2-hydroxy-, sodium salt 1:? PubChem CID: 131675399 IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylic acid;molecular hydrogen;sodium SMILES: [HH].C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Na]

PubChem CID 131675399
CAS 18996-35-5
Molecular Weight (g/mol) 217.129
MDL Number MFCD00013067
SMILES [HH].C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Na]
Synonym bicitra,pneucid,1,2,3-propanetricarboxylic acid, 2-hydroxy-, sodium salt,sodium dihydrogen citrate anhydrous,citric acid, sodium salt,citric acid sodium,sodium 2-hydroxy-1,2,3-propanetricarboxylate,2-hydroxypropane-1,2,3-tricarboxylic acid; sodium,1,2,3-propanetricarboxylic acid, 2-hydroxy-, sodium salt 1:?
IUPAC Name 2-hydroxypropane-1,2,3-tricarboxylic acid;molecular hydrogen;sodium
InChI Key SLWOXBQHKZPUNY-UHFFFAOYSA-N
Molecular Formula C6H10NaO7
635

Thermo Scientific Chemicals Cytidine 5'-monophosphate, 97%, from yeast

CAS: 63-37-6 Molecular Formula: C9H14N3O8P Molecular Weight (g/mol): 323.20 MDL Number: MFCD00006544 InChI Key: IERHLVCPSMICTF-NHBCCFCANA-N Synonym: 5'-cytidylic acid,cytidylic acid,cytidine 5'-monophosphate,cytidine monophosphate,cytidine-5'-monophosphate,5'-cmp,cytidylate,cytidine 5'-phosphate,cmp nucleotide,cytidine 5'-phosphoric acid PubChem CID: 6131 ChEBI: CHEBI:17361 IUPAC Name: [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate SMILES: NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O

PubChem CID 6131
CAS 63-37-6
Molecular Weight (g/mol) 323.20
ChEBI CHEBI:17361
MDL Number MFCD00006544
SMILES NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O
Synonym 5'-cytidylic acid,cytidylic acid,cytidine 5'-monophosphate,cytidine monophosphate,cytidine-5'-monophosphate,5'-cmp,cytidylate,cytidine 5'-phosphate,cmp nucleotide,cytidine 5'-phosphoric acid
IUPAC Name [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
InChI Key IERHLVCPSMICTF-NHBCCFCANA-N
Molecular Formula C9H14N3O8P
636

trans-4-Methylcyclohexanecarboxylic acid, 98%

CAS: 13064-83-0 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00074943,MFCD00074909,MFCD20617670 InChI Key: QTDXSEZXAPHVBI-UHFFFAOYSA-N Synonym: trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv PubChem CID: 20330 IUPAC Name: 4-methylcyclohexane-1-carboxylic acid SMILES: CC1CCC(CC1)C(O)=O

PubChem CID 20330
CAS 13064-83-0
Molecular Weight (g/mol) 142.20
MDL Number MFCD00074943,MFCD00074909,MFCD20617670
SMILES CC1CCC(CC1)C(O)=O
Synonym trans-4-methylcyclohexanecarboxylic acid,4-methylcyclohexanecarboxylic acid,4-methyl-1-cyclohexanecarboxylic acid,cis-4-methylcyclohexanecarboxylic acid,unii-70f0i2amtv,unii-m7dsk28350,trans-4-methyl-1-cyclohexanecarboxylic acid,trans-4-methyl hexahydrobenzoic acid,trans-4-methylcyclohexane carboxylic acid,70f0i2amtv
IUPAC Name 4-methylcyclohexane-1-carboxylic acid
InChI Key QTDXSEZXAPHVBI-UHFFFAOYSA-N
Molecular Formula C8H14O2
637

Methyl trans-2-pentenoate, 95%

CAS: 15790-88-2 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00137611 InChI Key: MBAHGFJTIVZLFB-SNAWJCMRSA-N Synonym: methyl 2-pentenoate,methyl trans-2-pentenoate,methyl 2e-pent-2-enoate,2-pentenoic acid, methyl ester,2-pentenoic acid, methyl ester, e,methyl 3-ethylacrylate,methyl 2-transpentenoate,methyl 2-trans-pentenoate,methyl e-2-pentenoate,trans-methyl pent-2-enoate PubChem CID: 5364718 SMILES: CC\C=C\C(=O)OC

PubChem CID 5364718
CAS 15790-88-2
Molecular Weight (g/mol) 114.14
MDL Number MFCD00137611
SMILES CC\C=C\C(=O)OC
Synonym methyl 2-pentenoate,methyl trans-2-pentenoate,methyl 2e-pent-2-enoate,2-pentenoic acid, methyl ester,2-pentenoic acid, methyl ester, e,methyl 3-ethylacrylate,methyl 2-transpentenoate,methyl 2-trans-pentenoate,methyl e-2-pentenoate,trans-methyl pent-2-enoate
InChI Key MBAHGFJTIVZLFB-SNAWJCMRSA-N
Molecular Formula C6H10O2
638

Acetoacetyl coenzyme A sodium salt, >90%, MP Biomedicals™

CAS: 102029-52-7 Molecular Formula: C25H40N7NaO18P3S Molecular Weight (g/mol): 874.597 InChI Key: RSOOKMDOLPTBRH-UHFFFAOYSA-N PubChem CID: 133112705 IUPAC Name: S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxobutanethioate;sodium SMILES: CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O.[Na]

PubChem CID 133112705
CAS 102029-52-7
Molecular Weight (g/mol) 874.597
SMILES CC(=O)CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O.[Na]
IUPAC Name S-[2-[3-[[4-[[[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-oxobutanethioate;sodium
InChI Key RSOOKMDOLPTBRH-UHFFFAOYSA-N
Molecular Formula C25H40N7NaO18P3S
639

Quinoline-8-boronic acid, tech. 90%

CAS: 86-58-8 Molecular Formula: C9H8BNO2 Molecular Weight (g/mol): 172.978 MDL Number: MFCD01114698 InChI Key: KXJJSKYICDAICD-UHFFFAOYSA-N Synonym: quinoline-8-boronic acid,8-quinolineboronic acid,8-quinolinylboronic acid,8-quinoline boronic acid,quinolin-8-yl boronic acid,8-boronoquinoline,8-quinolylboronic acid,boronic acid, 8-quinolinyl,unii-5qs1a25ij6,quinolin-8-yl-8-boronic acid PubChem CID: 2734380 IUPAC Name: quinolin-8-ylboronic acid SMILES: B(C1=C2C(=CC=C1)C=CC=N2)(O)O

PubChem CID 2734380
CAS 86-58-8
Molecular Weight (g/mol) 172.978
MDL Number MFCD01114698
SMILES B(C1=C2C(=CC=C1)C=CC=N2)(O)O
Synonym quinoline-8-boronic acid,8-quinolineboronic acid,8-quinolinylboronic acid,8-quinoline boronic acid,quinolin-8-yl boronic acid,8-boronoquinoline,8-quinolylboronic acid,boronic acid, 8-quinolinyl,unii-5qs1a25ij6,quinolin-8-yl-8-boronic acid
IUPAC Name quinolin-8-ylboronic acid
InChI Key KXJJSKYICDAICD-UHFFFAOYSA-N
Molecular Formula C9H8BNO2
640

3-(3-Fluorophenyl)propionic acid, 97%

CAS: 458-45-7 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD01310821 InChI Key: UBLMRADOKLXLCD-UHFFFAOYSA-N PubChem CID: 2737489 IUPAC Name: 3-(3-fluorophenyl)propanoic acid SMILES: C1=CC(=CC(=C1)F)CCC(=O)O

PubChem CID 2737489
CAS 458-45-7
Molecular Weight (g/mol) 168.167
MDL Number MFCD01310821
SMILES C1=CC(=CC(=C1)F)CCC(=O)O
IUPAC Name 3-(3-fluorophenyl)propanoic acid
InChI Key UBLMRADOKLXLCD-UHFFFAOYSA-N
Molecular Formula C9H9FO2
641

Sodium 1-nonanesulfonate, ≥99.0% (T), MilliporeSigma™ Supelco™

MDL Number: MFCD00025010 Synonym: 1-Nonanesulfonic acid sodium salt

MDL Number MFCD00025010
Synonym 1-Nonanesulfonic acid sodium salt
642

Benzyl cyanoacetate, 97%

CAS: 14447-18-8 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00051719 InChI Key: RCUIWQWWDLZNMS-UHFFFAOYSA-N Synonym: benzyl cyanoacetate,acetic acid, cyano-, phenylmethyl ester,cyanoacetic acid benzyl ester,benzyl-cyanoacetate,acetic acid, cyano-, benzyl ester,acmc-20alph,phenylmethyl 2-cyanoacetate,cyano-acetic acid benzyl ester,benzyl ester of cyanoacetic acid PubChem CID: 560818 IUPAC Name: benzyl 2-cyanoacetate SMILES: O=C(CC#N)OCC1=CC=CC=C1

PubChem CID 560818
CAS 14447-18-8
Molecular Weight (g/mol) 175.19
MDL Number MFCD00051719
SMILES O=C(CC#N)OCC1=CC=CC=C1
Synonym benzyl cyanoacetate,acetic acid, cyano-, phenylmethyl ester,cyanoacetic acid benzyl ester,benzyl-cyanoacetate,acetic acid, cyano-, benzyl ester,acmc-20alph,phenylmethyl 2-cyanoacetate,cyano-acetic acid benzyl ester,benzyl ester of cyanoacetic acid
IUPAC Name benzyl 2-cyanoacetate
InChI Key RCUIWQWWDLZNMS-UHFFFAOYSA-N
Molecular Formula C10H9NO2
643

Methyl o-toluate, 99%

CAS: 89-71-4 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00008428 InChI Key: WVWZECQNFWFVFW-UHFFFAOYSA-N Synonym: methyl o-toluate,methyl orthotoluate,o-toluic acid, methyl ester,methyl o-methylbenzoate,methyl toluate,benzoic acid, 2-methyl-, methyl ester,2-methylbenzoic acid methyl ester,o-toluic acid methyl ester,methyl-o-methyl benzoate,2-methyl methylbenzoate PubChem CID: 33094 IUPAC Name: methyl 2-methylbenzoate SMILES: CC1=CC=CC=C1C(=O)OC

PubChem CID 33094
CAS 89-71-4
Molecular Weight (g/mol) 150.177
MDL Number MFCD00008428
SMILES CC1=CC=CC=C1C(=O)OC
Synonym methyl o-toluate,methyl orthotoluate,o-toluic acid, methyl ester,methyl o-methylbenzoate,methyl toluate,benzoic acid, 2-methyl-, methyl ester,2-methylbenzoic acid methyl ester,o-toluic acid methyl ester,methyl-o-methyl benzoate,2-methyl methylbenzoate
IUPAC Name methyl 2-methylbenzoate
InChI Key WVWZECQNFWFVFW-UHFFFAOYSA-N
Molecular Formula C9H10O2
644

LiChropur™ Butylboronic Acid, For GC Derivatization, 96.0% (T), MilliporeSigma™ Supelco™

CAS: 4426-47-5 Molecular Formula: C4H11BO2 Molecular Weight (g/mol): 101.94 MDL Number: MFCD00002106 InChI Key: QPKFVRWIISEVCW-UHFFFAOYSA-N Synonym: 1-Butaneboronic acid IUPAC Name: butylboronic acid SMILES: CCCCB(O)O

CAS 4426-47-5
Molecular Weight (g/mol) 101.94
MDL Number MFCD00002106
SMILES CCCCB(O)O
Synonym 1-Butaneboronic acid
IUPAC Name butylboronic acid
InChI Key QPKFVRWIISEVCW-UHFFFAOYSA-N
Molecular Formula C4H11BO2
645

Methyl alpha-chloroacrylate, 98+%, stabilized with hydroquinone

CAS: 80-63-7 Molecular Formula: C4H5ClO2 Molecular Weight (g/mol): 120.54 MDL Number: MFCD00051368 InChI Key: AWJZTPWDQYFQPQ-UHFFFAOYSA-N Synonym: methyl 2-chloroacrylate,methyl alpha-chloroacrylate,methyl-2-chloroacrylate,2-propenoic acid, 2-chloro-, methyl ester,methyl-alpha-chloroacrylate,2-chloroacrylic acid, methyl ester,methyl 2-chloro-2-propenoate,acrylic acid, 2-chloro-, methyl ester,methyl 2-chloro-2-propenate,unii-47pg4l077j PubChem CID: 6659 IUPAC Name: methyl 2-chloroprop-2-enoate SMILES: COC(=O)C(=C)Cl

PubChem CID 6659
CAS 80-63-7
Molecular Weight (g/mol) 120.54
MDL Number MFCD00051368
SMILES COC(=O)C(=C)Cl
Synonym methyl 2-chloroacrylate,methyl alpha-chloroacrylate,methyl-2-chloroacrylate,2-propenoic acid, 2-chloro-, methyl ester,methyl-alpha-chloroacrylate,2-chloroacrylic acid, methyl ester,methyl 2-chloro-2-propenoate,acrylic acid, 2-chloro-, methyl ester,methyl 2-chloro-2-propenate,unii-47pg4l077j
IUPAC Name methyl 2-chloroprop-2-enoate
InChI Key AWJZTPWDQYFQPQ-UHFFFAOYSA-N
Molecular Formula C4H5ClO2