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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 (120)
Organic sulfonic acids and derivatives (18)
Acrylic acids and derivatives (15)
Boronic acid derivatives (12)
Carbothioic Derivatives (8)
Alpha-halocarboxylic acids and derivatives (6)
Organic phosphonic acids and derivatives (5)
Cyclopropanecarboxylic acids and derivatives (4)
Hydroxy acids and derivatives (3)
Carboximidic acids and derivatives (2)
Organic sulfuric acids and derivatives (1)

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Propionic Acid (Certified ACS), Fisher Chemical
GSA_VA

CAS: 79-09-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00002756 InChI Key: XBDQKXXYIPTUBI-UHFFFAOYSA-N Synonym: propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin PubChem CID: 1032 ChEBI: CHEBI:30768 IUPAC Name: propanoic acid SMILES: CCC(=O)O

EDGE
PubChem CID 1032
CAS 79-09-4
Molecular Weight (g/mol) 74.079
ChEBI CHEBI:30768
MDL Number MFCD00002756
SMILES CCC(=O)O
Synonym propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin
IUPAC Name propanoic acid
InChI Key XBDQKXXYIPTUBI-UHFFFAOYSA-N
Molecular Formula C3H6O2
2

Thioacetic acid, 98%

CAS: 507-09-5 Molecular Formula: C2H4OS Molecular Weight (g/mol): 76.11 MDL Number: MFCD00004853 InChI Key: DUYAAUVXQSMXQP-UHFFFAOYSA-N Synonym: thioacetic acid,ethanethioic acid,thiacetic acid,thioacetic s-acid,acetyl mercaptan,ethanethiolic acid,thiolacetic acid,thionoacetic acid,methanecarbothiolic acid,ch3cosh PubChem CID: 10484 ChEBI: CHEBI:16555 IUPAC Name: ethanethioic S-acid SMILES: CC(S)=O

EDGE
PubChem CID 10484
CAS 507-09-5
Molecular Weight (g/mol) 76.11
ChEBI CHEBI:16555
MDL Number MFCD00004853
SMILES CC(S)=O
Synonym thioacetic acid,ethanethioic acid,thiacetic acid,thioacetic s-acid,acetyl mercaptan,ethanethiolic acid,thiolacetic acid,thionoacetic acid,methanecarbothiolic acid,ch3cosh
IUPAC Name ethanethioic S-acid
InChI Key DUYAAUVXQSMXQP-UHFFFAOYSA-N
Molecular Formula C2H4OS
3

1,3-Phenylenediamine Sulfate 98.0+%, TCI America™

CAS: 541-70-8 Molecular Formula: C6H10N2O4S Molecular Weight (g/mol): 206.216 MDL Number: MFCD00060223 InChI Key: LDXYDHGRKFMULJ-UHFFFAOYSA-N Synonym: 1,3-Diaminobenzene Sulfate PubChem CID: 10942 IUPAC Name: benzene-1,3-diamine;sulfuric acid SMILES: C1=CC(=CC(=C1)N)N.OS(=O)(=O)O

PubChem CID 10942
CAS 541-70-8
Molecular Weight (g/mol) 206.216
MDL Number MFCD00060223
SMILES C1=CC(=CC(=C1)N)N.OS(=O)(=O)O
Synonym 1,3-Diaminobenzene Sulfate
IUPAC Name benzene-1,3-diamine;sulfuric acid
InChI Key LDXYDHGRKFMULJ-UHFFFAOYSA-N
Molecular Formula C6H10N2O4S
4

3-Nitrobenzamide 98.0+%, TCI America™

CAS: 645-09-0 Molecular Formula: C7H6N2O3 Molecular Weight (g/mol): 166.136 MDL Number: MFCD00007984 InChI Key: KWAYEPXDGHYGRW-UHFFFAOYSA-N Synonym: m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732 PubChem CID: 12576 IUPAC Name: 3-nitrobenzamide SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N

PubChem CID 12576
CAS 645-09-0
Molecular Weight (g/mol) 166.136
MDL Number MFCD00007984
SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N
Synonym m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732
IUPAC Name 3-nitrobenzamide
InChI Key KWAYEPXDGHYGRW-UHFFFAOYSA-N
Molecular Formula C7H6N2O3
5

Thermo Scientific Chemicals Tris(2-carboxyethyl)phosphine hydrochloride, 98%, Molecular Biology Grade

CAS: 51805-45-9 Molecular Formula: C9H12O6P Molecular Weight (g/mol): 247.16 MDL Number: MFCD00145469 InChI Key: PZBFGYYEXUXCOF-UHFFFAOYSA-K Synonym: tris 2-carboxyethyl phosphine hydrochloride,tcep hcl,tcep hydrochloride,3,3',3-phosphinetriyltripropanoic acid hydrochloride,tcep,unii-h49aam893k,tris carboxyethyl phosphine hydrochloride,tris-2-carboxyethyl phosphine hydrochloride,tris 2-carboxyethyl phosphine hcl,3,3',3-phosphinetriyltripropanoicacidhydrochloride PubChem CID: 2734570 IUPAC Name: 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid;hydrochloride SMILES: [O-]C(=O)CCP(CCC([O-])=O)CCC([O-])=O

PubChem CID 2734570
CAS 51805-45-9
Molecular Weight (g/mol) 247.16
MDL Number MFCD00145469
SMILES [O-]C(=O)CCP(CCC([O-])=O)CCC([O-])=O
Synonym tris 2-carboxyethyl phosphine hydrochloride,tcep hcl,tcep hydrochloride,3,3',3-phosphinetriyltripropanoic acid hydrochloride,tcep,unii-h49aam893k,tris carboxyethyl phosphine hydrochloride,tris-2-carboxyethyl phosphine hydrochloride,tris 2-carboxyethyl phosphine hcl,3,3',3-phosphinetriyltripropanoicacidhydrochloride
IUPAC Name 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid;hydrochloride
InChI Key PZBFGYYEXUXCOF-UHFFFAOYSA-K
Molecular Formula C9H12O6P
6
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Isovaleramide, 98%

CAS: 541-46-8 Molecular Formula: C5H11NO Molecular Weight (g/mol): 101.149 MDL Number: MFCD00014807 InChI Key: SANOUVWGPVYVAV-UHFFFAOYSA-N Synonym: isovaleramide,butanamide, 3-methyl,3-methylbutyramide,isovaleric amide,isopentanamide,beta-methylbutyramide,isovaleric acid amide,unii-9cp4kb634m,isovaleramide usan,.beta.-methylbutyramide PubChem CID: 10930 IUPAC Name: 3-methylbutanamide SMILES: CC(C)CC(=O)N

PubChem CID 10930
CAS 541-46-8
Molecular Weight (g/mol) 101.149
MDL Number MFCD00014807
SMILES CC(C)CC(=O)N
Synonym isovaleramide,butanamide, 3-methyl,3-methylbutyramide,isovaleric amide,isopentanamide,beta-methylbutyramide,isovaleric acid amide,unii-9cp4kb634m,isovaleramide usan,.beta.-methylbutyramide
IUPAC Name 3-methylbutanamide
InChI Key SANOUVWGPVYVAV-UHFFFAOYSA-N
Molecular Formula C5H11NO
7

(3-Bromopropyl)phosphonic Acid 98.0+%, TCI America™

CAS: 1190-09-6 Molecular Formula: C3H8BrO3P Molecular Weight (g/mol): 202.972 MDL Number: MFCD00191385 InChI Key: CXOIECRVHUDBSA-UHFFFAOYSA-N Synonym: 3-Bromopropanephosphonic Acid PubChem CID: 4376761 IUPAC Name: 3-bromopropylphosphonic acid SMILES: C(CP(=O)(O)O)CBr

PubChem CID 4376761
CAS 1190-09-6
Molecular Weight (g/mol) 202.972
MDL Number MFCD00191385
SMILES C(CP(=O)(O)O)CBr
Synonym 3-Bromopropanephosphonic Acid
IUPAC Name 3-bromopropylphosphonic acid
InChI Key CXOIECRVHUDBSA-UHFFFAOYSA-N
Molecular Formula C3H8BrO3P
8

Methyl 3-Methoxypropionate 99.0+%, TCI America™

CAS: 3852-09-3 Molecular Formula: C5H10O3 Molecular Weight (g/mol): 118.13 MDL Number: MFCD00059085 InChI Key: BDJSOPWXYLFTNW-UHFFFAOYSA-N Synonym: 3-Methoxypropionic Acid Methyl Ester PubChem CID: 19710 IUPAC Name: methyl 3-methoxypropanoate SMILES: COCCC(=O)OC

PubChem CID 19710
CAS 3852-09-3
Molecular Weight (g/mol) 118.13
MDL Number MFCD00059085
SMILES COCCC(=O)OC
Synonym 3-Methoxypropionic Acid Methyl Ester
IUPAC Name methyl 3-methoxypropanoate
InChI Key BDJSOPWXYLFTNW-UHFFFAOYSA-N
Molecular Formula C5H10O3
9

2-Ethylhexyl Acetate 98.0+%, TCI America™

CAS: 103-09-3 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.27 MDL Number: MFCD00027249 InChI Key: WOYWLLHHWAMFCB-UHFFFAOYNA-N Synonym: acetic acid, 2-ethylhexyl ester,2-ethyl-1-hexanol acetate,2-ethylhexyl ethanoate,2-ethyl-1-hexyl acetate,2-ethylhexanyl acetate,2-ethylhexylacetate,beta-ethylhexyl acetate,acetic acid 2-ethylhexyl ester,fema number 2806,2-ethylhexylester kyseliny octove PubChem CID: 7635 ChEBI: CHEBI:87392 IUPAC Name: 2-ethylhexyl acetate SMILES: CCCCC(CC)COC(C)=O

PubChem CID 7635
CAS 103-09-3
Molecular Weight (g/mol) 172.27
ChEBI CHEBI:87392
MDL Number MFCD00027249
SMILES CCCCC(CC)COC(C)=O
Synonym acetic acid, 2-ethylhexyl ester,2-ethyl-1-hexanol acetate,2-ethylhexyl ethanoate,2-ethyl-1-hexyl acetate,2-ethylhexanyl acetate,2-ethylhexylacetate,beta-ethylhexyl acetate,acetic acid 2-ethylhexyl ester,fema number 2806,2-ethylhexylester kyseliny octove
IUPAC Name 2-ethylhexyl acetate
InChI Key WOYWLLHHWAMFCB-UHFFFAOYNA-N
Molecular Formula C10H20O2
10

2,2,3,3-Tetrafluoropropionic Acid 95.0+%, TCI America™

CAS: 756-09-2 Molecular Formula: C3H2F4O2 Molecular Weight (g/mol): 146.041 MDL Number: MFCD00054686 InChI Key: PXRROZVNOOEPPZ-UHFFFAOYSA-N Synonym: flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa PubChem CID: 69789 ChEBI: CHEBI:82013 IUPAC Name: 2,2,3,3-tetrafluoropropanoic acid SMILES: C(C(C(=O)O)(F)F)(F)F

PubChem CID 69789
CAS 756-09-2
Molecular Weight (g/mol) 146.041
ChEBI CHEBI:82013
MDL Number MFCD00054686
SMILES C(C(C(=O)O)(F)F)(F)F
Synonym flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa
IUPAC Name 2,2,3,3-tetrafluoropropanoic acid
InChI Key PXRROZVNOOEPPZ-UHFFFAOYSA-N
Molecular Formula C3H2F4O2
11

3-Hexyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene 97.0+%, TCI America™

CAS: 850881-09-3 Molecular Formula: C16H27BO2S Molecular Weight (g/mol): 294.26 MDL Number: MFCD11045447 InChI Key: XCXAUPBHQCCWCI-UHFFFAOYSA-N Synonym: 2-(3-Hexyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 3-Hexyl-2-thiopheneboronic Acid Pinacol Ester PubChem CID: 16663552 IUPAC Name: 2-(3-hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(C=CS2)CCCCCC

PubChem CID 16663552
CAS 850881-09-3
Molecular Weight (g/mol) 294.26
MDL Number MFCD11045447
SMILES B1(OC(C(O1)(C)C)(C)C)C2=C(C=CS2)CCCCCC
Synonym 2-(3-Hexyl-2-thienyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 3-Hexyl-2-thiopheneboronic Acid Pinacol Ester
IUPAC Name 2-(3-hexylthiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI Key XCXAUPBHQCCWCI-UHFFFAOYSA-N
Molecular Formula C16H27BO2S
12
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3-Nitrobenzamide, 98%

CAS: 645-09-0 Molecular Formula: C7H6N2O3 Molecular Weight (g/mol): 166.14 MDL Number: MFCD00007984 InChI Key: KWAYEPXDGHYGRW-UHFFFAOYSA-N Synonym: m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732 PubChem CID: 12576 IUPAC Name: 3-nitrobenzamide SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N

PubChem CID 12576
CAS 645-09-0
Molecular Weight (g/mol) 166.14
MDL Number MFCD00007984
SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N
Synonym m-nitrobenzamide,benzamide, 3-nitro,benzamide, m-nitro,3-nitro-benzamide,3-nitrophenylcarboxamide,acmc-209nmr,3-nitrobenzamide,dsstox_cid_5732,dsstox_rid_77897,dsstox_gsid_25732
IUPAC Name 3-nitrobenzamide
InChI Key KWAYEPXDGHYGRW-UHFFFAOYSA-N
Molecular Formula C7H6N2O3
13

Methyl 2,3-Dichloropropionate 95.0+%, TCI America™

CAS: 3674-09-7 Molecular Formula: C4H6Cl2O2 Molecular Weight (g/mol): 156.99 MDL Number: MFCD00000944 InChI Key: OFHMODDLBXETIK-UHFFFAOYNA-N Synonym: methyl 2,3-dichloropropionate,propanoic acid, 2,3-dichloro-, methyl ester,2,3-dichloropropionic acid methyl ester,methyl-2,3-dichloropropionate,methyl alpha,beta-dichloropropionate,methyl .alpha.,.beta.-dichloropropionate,propionic acid, 2,3-dichloro-, methyl ester,propanoic acid,3-dichloro-, methyl ester,propionic acid,3-dichloro-, methyl ester,methyl-2,3-dichloropropioate PubChem CID: 95429 IUPAC Name: methyl 2,3-dichloropropanoate SMILES: COC(=O)C(CCl)Cl

PubChem CID 95429
CAS 3674-09-7
Molecular Weight (g/mol) 156.99
MDL Number MFCD00000944
SMILES COC(=O)C(CCl)Cl
Synonym methyl 2,3-dichloropropionate,propanoic acid, 2,3-dichloro-, methyl ester,2,3-dichloropropionic acid methyl ester,methyl-2,3-dichloropropionate,methyl alpha,beta-dichloropropionate,methyl .alpha.,.beta.-dichloropropionate,propionic acid, 2,3-dichloro-, methyl ester,propanoic acid,3-dichloro-, methyl ester,propionic acid,3-dichloro-, methyl ester,methyl-2,3-dichloropropioate
IUPAC Name methyl 2,3-dichloropropanoate
InChI Key OFHMODDLBXETIK-UHFFFAOYNA-N
Molecular Formula C4H6Cl2O2
14

TATU 98.0+%, TCI America™

CAS: 873798-09-5 Molecular Formula: C10H15BF4N6O Molecular Weight (g/mol): 322.075 InChI Key: AUPDFAPCZZXFMX-UHFFFAOYSA-N Synonym: 1-[Bis(dimethylamino)methylene]-1H-1,2,3-triazolo[4,5-b]pyridinium 3-Oxide Tetrafluoroborate PubChem CID: 11099301 IUPAC Name: [dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazanium;tetrafluoroborate SMILES: [B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C2=C(C=CC=N2)N=N1

PubChem CID 11099301
CAS 873798-09-5
Molecular Weight (g/mol) 322.075
SMILES [B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C2=C(C=CC=N2)N=N1
Synonym 1-[Bis(dimethylamino)methylene]-1H-1,2,3-triazolo[4,5-b]pyridinium 3-Oxide Tetrafluoroborate
IUPAC Name [dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazanium;tetrafluoroborate
InChI Key AUPDFAPCZZXFMX-UHFFFAOYSA-N
Molecular Formula C10H15BF4N6O
15
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Methyl oxalyl chloride, 97%

CAS: 5781-53-3 Molecular Formula: C3H3ClO3 Molecular Weight (g/mol): 122.51 MDL Number: MFCD00000705 InChI Key: ZXUQEPZWVQIOJE-UHFFFAOYSA-N Synonym: methyl oxalyl chloride,methyl chloroglyoxylate,methyl chlorooxoacetate,chloroglyoxylic acid methyl ester,acetic acid, chlorooxo-, methyl ester,methyl chlorocarbonyl formate,methyloxalylchloride,methyl chloro oxo acetate,methylchlorooxoacetate,methyl 2-chloro-2-oxo-acetate PubChem CID: 79846 IUPAC Name: methyl 2-chloro-2-oxoacetate SMILES: COC(=O)C(=O)Cl

PubChem CID 79846
CAS 5781-53-3
Molecular Weight (g/mol) 122.51
MDL Number MFCD00000705
SMILES COC(=O)C(=O)Cl
Synonym methyl oxalyl chloride,methyl chloroglyoxylate,methyl chlorooxoacetate,chloroglyoxylic acid methyl ester,acetic acid, chlorooxo-, methyl ester,methyl chlorocarbonyl formate,methyloxalylchloride,methyl chloro oxo acetate,methylchlorooxoacetate,methyl 2-chloro-2-oxo-acetate
IUPAC Name methyl 2-chloro-2-oxoacetate
InChI Key ZXUQEPZWVQIOJE-UHFFFAOYSA-N
Molecular Formula C3H3ClO3