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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.
Carboxylic acids and derivatives (107)
Carbothioic Derivatives (11)
Boronic acid derivatives (10)
Organic sulfonic acids and derivatives (7)
Acrylic acids and derivatives (5)
Alpha-halocarboxylic acids and derivatives (4)
Organic phosphoric acids and derivatives (4)
Organic sulfuric acids and derivatives (3)
Vinylogous acids (3)
Hydroxy acids and derivatives (2)
Organic carbonic acids and derivatives (2)
Organic phosphonic acids and derivatives (1)

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1 – 15 of 95 results
1
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Methyl cyanoacetate, 97%

CAS: 105-34-0 Molecular Formula: C4H5NO2 Molecular Weight (g/mol): 99.09 MDL Number: MFCD00001939 InChI Key: ANGDWNBGPBMQHW-UHFFFAOYSA-N Synonym: methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate PubChem CID: 7747 ChEBI: CHEBI:51928 IUPAC Name: methyl 2-cyanoacetate SMILES: COC(=O)CC#N

EDGE
PubChem CID 7747
CAS 105-34-0
Molecular Weight (g/mol) 99.09
ChEBI CHEBI:51928
MDL Number MFCD00001939
SMILES COC(=O)CC#N
Synonym methyl cyanoacetate,cyanoacetic acid methyl ester,methyl cyanoethanoate,acetic acid, cyano-, methyl ester,usaf kf-22,methylester kyseliny kyanoctove,methylcyanoacetate,malonic methyl ester nitrile,acetic acid, 2-cyano-, methyl ester,methyl cyano acetate
IUPAC Name methyl 2-cyanoacetate
InChI Key ANGDWNBGPBMQHW-UHFFFAOYSA-N
Molecular Formula C4H5NO2
2

Potassium Isobutyrate 98.0+%, TCI America™

CAS: 19455-20-0 Molecular Formula: C4H7KO2 Molecular Weight (g/mol): 126.196 MDL Number: MFCD00058992 InChI Key: LBOHISOWGKIIKX-UHFFFAOYSA-M Synonym: Isobutyric Acid Potassium Salt PubChem CID: 23677462 IUPAC Name: potassium;2-methylpropanoate SMILES: CC(C)C(=O)[O-].[K+]

PubChem CID 23677462
CAS 19455-20-0
Molecular Weight (g/mol) 126.196
MDL Number MFCD00058992
SMILES CC(C)C(=O)[O-].[K+]
Synonym Isobutyric Acid Potassium Salt
IUPAC Name potassium;2-methylpropanoate
InChI Key LBOHISOWGKIIKX-UHFFFAOYSA-M
Molecular Formula C4H7KO2
3

1-Methylpyrazole-3-carboxylic Acid 97.0+%, TCI America™

CAS: 25016-20-0 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00464254 InChI Key: YBFIKNNFQIBIQZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid PubChem CID: 573176 ChEBI: CHEBI:74738 IUPAC Name: 1-methyl-1H-pyrazole-3-carboxylic acid SMILES: CN1C=CC(=N1)C(O)=O

PubChem CID 573176
CAS 25016-20-0
Molecular Weight (g/mol) 126.12
ChEBI CHEBI:74738
MDL Number MFCD00464254
SMILES CN1C=CC(=N1)C(O)=O
Synonym 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid
IUPAC Name 1-methyl-1H-pyrazole-3-carboxylic acid
InChI Key YBFIKNNFQIBIQZ-UHFFFAOYSA-N
Molecular Formula C5H6N2O2
4

1,3,4,6-Tetra-O-acetyl-2-azido-2-deoxy-alpha-D-mannopyranose 98.0+%, TCI America™

CAS: 68733-20-0 Molecular Formula: C14H19N3O9 Molecular Weight (g/mol): 373.318 MDL Number: MFCD01321201 InChI Key: QKGHBQJLEHAMKJ-ITGHMWBKSA-N PubChem CID: 11291742 IUPAC Name: [(2R,3S,4R,5S,6R)-3,4,6-triacetyloxy-5-azidooxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)N=[N+]=[N-])OC(=O)C)OC(=O)C

PubChem CID 11291742
CAS 68733-20-0
Molecular Weight (g/mol) 373.318
MDL Number MFCD01321201
SMILES CC(=O)OCC1C(C(C(C(O1)OC(=O)C)N=[N+]=[N-])OC(=O)C)OC(=O)C
IUPAC Name [(2R,3S,4R,5S,6R)-3,4,6-triacetyloxy-5-azidooxan-2-yl]methyl acetate
InChI Key QKGHBQJLEHAMKJ-ITGHMWBKSA-N
Molecular Formula C14H19N3O9
5
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Isopropyl Myristate, NF, 90%, Spectrum™ Chemical
SDP

CAS: 110-27-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.46 InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N IUPAC Name: propan-2-yl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OC(C)C

CAS 110-27-0
Molecular Weight (g/mol) 270.46
SMILES CCCCCCCCCCCCCC(=O)OC(C)C
IUPAC Name propan-2-yl tetradecanoate
InChI Key AXISYYRBXTVTFY-UHFFFAOYSA-N
Molecular Formula C17H34O2
6
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O-Methylisourea hemisulfate, 94%

CAS: 52328-05-9 Molecular Formula: 0·5 H2SO4 Molecular Weight (g/mol): 123.12 MDL Number: MFCD00040594 InChI Key: QSCPQKVWSNUJLJ-UHFFFAOYSA-N Synonym: o-methylisourea hemisulfate,2-methylisouronium sulfate,o-methylisourea hemisulfate salt,bis methoxymethanimidamide ; sulfuric acid,carbamimidic acid, methyl ester, sulfate 2:1,omi™,o-methylpseudourea sulfate,0-methylisourea hemisulfate,o-methylisourea hemisulphate,bis 2-methylisouronium sulphate PubChem CID: 11357018 IUPAC Name: methyl carbamimidate;sulfuric acid SMILES: COC(=N)N.COC(=N)N.OS(=O)(=O)O

PubChem CID 11357018
CAS 52328-05-9
Molecular Weight (g/mol) 123.12
MDL Number MFCD00040594
SMILES COC(=N)N.COC(=N)N.OS(=O)(=O)O
Synonym o-methylisourea hemisulfate,2-methylisouronium sulfate,o-methylisourea hemisulfate salt,bis methoxymethanimidamide ; sulfuric acid,carbamimidic acid, methyl ester, sulfate 2:1,omi™,o-methylpseudourea sulfate,0-methylisourea hemisulfate,o-methylisourea hemisulphate,bis 2-methylisouronium sulphate
IUPAC Name methyl carbamimidate;sulfuric acid
InChI Key QSCPQKVWSNUJLJ-UHFFFAOYSA-N
Molecular Formula 0·5 H2SO4
7
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Thermo Scientific Chemicals Nicotinamide, 99%

CAS: 98-92-0 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.13 MDL Number: MFCD00006395 InChI Key: DFPAKSUCGFBDDF-UHFFFAOYSA-N Synonym: nicotinamide,niacinamide,3-pyridinecarboxamide,vitamin pp,nicotinic acid amide,papulex,aminicotin,amixicotyn,nicobion,nicotylamide PubChem CID: 936 ChEBI: CHEBI:17154 IUPAC Name: pyridine-3-carboxamide SMILES: C1=CC(=CN=C1)C(=O)N

PubChem CID 936
CAS 98-92-0
Molecular Weight (g/mol) 122.13
ChEBI CHEBI:17154
MDL Number MFCD00006395
SMILES C1=CC(=CN=C1)C(=O)N
Synonym nicotinamide,niacinamide,3-pyridinecarboxamide,vitamin pp,nicotinic acid amide,papulex,aminicotin,amixicotyn,nicobion,nicotylamide
IUPAC Name pyridine-3-carboxamide
InChI Key DFPAKSUCGFBDDF-UHFFFAOYSA-N
Molecular Formula C6H6N2O
8

2,6-Difluoro-4-methoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™

CAS: 406482-20-0 Molecular Formula: C7H7BF2O3 Molecular Weight (g/mol): 187.94 MDL Number: MFCD05664299 InChI Key: WVSZSFADEBGONQ-UHFFFAOYSA-N Synonym: 2,6-Difluoro-4-methoxybenzeneboronic Acid PubChem CID: 16217424 IUPAC Name: (2,6-difluoro-4-methoxyphenyl)boronic acid SMILES: COC1=CC(F)=C(B(O)O)C(F)=C1

PubChem CID 16217424
CAS 406482-20-0
Molecular Weight (g/mol) 187.94
MDL Number MFCD05664299
SMILES COC1=CC(F)=C(B(O)O)C(F)=C1
Synonym 2,6-Difluoro-4-methoxybenzeneboronic Acid
IUPAC Name (2,6-difluoro-4-methoxyphenyl)boronic acid
InChI Key WVSZSFADEBGONQ-UHFFFAOYSA-N
Molecular Formula C7H7BF2O3
9
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Isopropyl tetradecanoate, 98%

CAS: 110-27-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.457 MDL Number: MFCD00008982 InChI Key: AXISYYRBXTVTFY-UHFFFAOYSA-N Synonym: isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester PubChem CID: 8042 IUPAC Name: propan-2-yl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OC(C)C

PubChem CID 8042
CAS 110-27-0
Molecular Weight (g/mol) 270.457
MDL Number MFCD00008982
SMILES CCCCCCCCCCCCCC(=O)OC(C)C
Synonym isopropyl myristate,isopropyl tetradecanoate,estergel,bisomel,isomyst,promyr,tetradecanoic acid, 1-methylethyl ester,deltyl extra,kesscomir,tegester
IUPAC Name propan-2-yl tetradecanoate
InChI Key AXISYYRBXTVTFY-UHFFFAOYSA-N
Molecular Formula C17H34O2
10

Trifluoroacetic Anhydride 98.0+%, TCI America™

CAS: 407-25-0 Molecular Formula: C4F6O3 Molecular Weight (g/mol): 210.03 MDL Number: MFCD00000416 InChI Key: QAEDZJGFFMLHHQ-UHFFFAOYSA-N Synonym: trifluoroacetic anhydride,trifluoroacetic acid anhydride,2,2,2-trifluoroacetic anhydride,bis trifluoroacetic anhydride,acetic acid, trifluoro-, anhydride,perfluoroacetic anhydride,trifluoroacetyl anhydride,tfaa,hexafluoroacetic anhydride,anhydrid kyseliny trifluoroctove PubChem CID: 9845 IUPAC Name: 2,2,2-trifluoroacetyl 2,2,2-trifluoroacetate SMILES: FC(F)(F)C(=O)OC(=O)C(F)(F)F

PubChem CID 9845
CAS 407-25-0
Molecular Weight (g/mol) 210.03
MDL Number MFCD00000416
SMILES FC(F)(F)C(=O)OC(=O)C(F)(F)F
Synonym trifluoroacetic anhydride,trifluoroacetic acid anhydride,2,2,2-trifluoroacetic anhydride,bis trifluoroacetic anhydride,acetic acid, trifluoro-, anhydride,perfluoroacetic anhydride,trifluoroacetyl anhydride,tfaa,hexafluoroacetic anhydride,anhydrid kyseliny trifluoroctove
IUPAC Name 2,2,2-trifluoroacetyl 2,2,2-trifluoroacetate
InChI Key QAEDZJGFFMLHHQ-UHFFFAOYSA-N
Molecular Formula C4F6O3
11

Triethyl citrate, 99%

CAS: 77-93-0 Molecular Formula: C12H20O7 Molecular Weight (g/mol): 276.29 InChI Key: DOOTYTYQINUNNV-UHFFFAOYSA-N Synonym: triethyl citrate,ethyl citrate,citroflex 2,eudraflex,hydragen cat,citric acid, triethyl ester,triaethylcitrat,triethylcitrate,citric acid triethyl ester,1,2,3-propanetricarboxylic acid, 2-hydroxy-, triethyl ester PubChem CID: 6506 IUPAC Name: triethyl 2-hydroxypropane-1,2,3-tricarboxylate SMILES: CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O

PubChem CID 6506
CAS 77-93-0
Molecular Weight (g/mol) 276.29
SMILES CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O
Synonym triethyl citrate,ethyl citrate,citroflex 2,eudraflex,hydragen cat,citric acid, triethyl ester,triaethylcitrat,triethylcitrate,citric acid triethyl ester,1,2,3-propanetricarboxylic acid, 2-hydroxy-, triethyl ester
IUPAC Name triethyl 2-hydroxypropane-1,2,3-tricarboxylate
InChI Key DOOTYTYQINUNNV-UHFFFAOYSA-N
Molecular Formula C12H20O7
12
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1-Acetylpiperazine, 98%

CAS: 13889-98-0 MDL Number: MFCD00058676 Synonym: 1-acetylpiperazine,n-acetylpiperazine,1-piperazin-1-yl ethanone,1-piperazin-1-yl ethan-1-one,n-acetyl piperazine,acetylpiperazine,1-acetyl piperazine,piperazine, 1-acetyl,1-piperazin-1-yl-ethanone,1-piperazin-1-yl ethanon PubChem CID: 83795 IUPAC Name: 1-piperazin-1-ylethanone

PubChem CID 83795
CAS 13889-98-0
MDL Number MFCD00058676
Synonym 1-acetylpiperazine,n-acetylpiperazine,1-piperazin-1-yl ethanone,1-piperazin-1-yl ethan-1-one,n-acetyl piperazine,acetylpiperazine,1-acetyl piperazine,piperazine, 1-acetyl,1-piperazin-1-yl-ethanone,1-piperazin-1-yl ethanon
IUPAC Name 1-piperazin-1-ylethanone
13
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tert-Butyldimethylsilyl trifluoromethanesulfonate, 98%

CAS: 69739-34-0 Molecular Formula: C7H15F3O3SSi Molecular Weight (g/mol): 264.33 MDL Number: MFCD00000405 InChI Key: WLLIXJBWWFGEHT-UHFFFAOYSA-N Synonym: tert-butyldimethylsilyl trifluoromethanesulfonate,trifluoromethanesulfonic acid tert-butyldimethylsilyl ester,tbdms triflate,t-butyldimethylsilyl triflate,tert-butyldimethylsilyl trifluoromethanesulphonate,tbdms-otf,tert-butyldimethylsilyl triflate,silane tbm2 triflate,t-butyldimethylsilyltrifluoromethanesulfonate,t-butylmethylsilyl triflate PubChem CID: 123564 IUPAC Name: [tert-butyl(dimethyl)silyl] trifluoromethanesulfonate SMILES: CC(C)(C)[Si](C)(C)OS(=O)(=O)C(F)(F)F

PubChem CID 123564
CAS 69739-34-0
Molecular Weight (g/mol) 264.33
MDL Number MFCD00000405
SMILES CC(C)(C)[Si](C)(C)OS(=O)(=O)C(F)(F)F
Synonym tert-butyldimethylsilyl trifluoromethanesulfonate,trifluoromethanesulfonic acid tert-butyldimethylsilyl ester,tbdms triflate,t-butyldimethylsilyl triflate,tert-butyldimethylsilyl trifluoromethanesulphonate,tbdms-otf,tert-butyldimethylsilyl triflate,silane tbm2 triflate,t-butyldimethylsilyltrifluoromethanesulfonate,t-butylmethylsilyl triflate
IUPAC Name [tert-butyl(dimethyl)silyl] trifluoromethanesulfonate
InChI Key WLLIXJBWWFGEHT-UHFFFAOYSA-N
Molecular Formula C7H15F3O3SSi
14
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Triethyl phosphate, 98+%

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

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
15
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Cycloheptylacetic acid, 99%

CAS: 4401-20-1 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.225 MDL Number: MFCD01075701 InChI Key: DQNWKASPZFJVMJ-UHFFFAOYSA-N Synonym: cycloheptylacetic acid,cycloheptaneacetic acid,2-cycloheptylaceticacid,pubchem16200,acmc-20ald3 PubChem CID: 227401 IUPAC Name: 2-cycloheptylacetic acid SMILES: C1CCCC(CC1)CC(=O)O

PubChem CID 227401
CAS 4401-20-1
Molecular Weight (g/mol) 156.225
MDL Number MFCD01075701
SMILES C1CCCC(CC1)CC(=O)O
Synonym cycloheptylacetic acid,cycloheptaneacetic acid,2-cycloheptylaceticacid,pubchem16200,acmc-20ald3
IUPAC Name 2-cycloheptylacetic acid
InChI Key DQNWKASPZFJVMJ-UHFFFAOYSA-N
Molecular Formula C9H16O2