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Phthalic acid and derivatives

Organic compounds that consist of benzoic acid with an additional carboxylic acid substitution, both groups are located in adjacent carbon atoms; includes compounds that are directly derived from phthalic acid.
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31 – 45 of 272 results
31

3,5-Bis(methoxycarbonyl)benzeneboronic acid, 97%

CAS: 177735-55-6 Molecular Formula: C10H11BO6 Molecular Weight (g/mol): 238.00 MDL Number: MFCD11053854 InChI Key: WEJWFDLAZSVCJK-UHFFFAOYSA-N Synonym: 3,5-bis methoxycarbonyl phenylboronic acid,3,5-bis methoxycarbonyl phenyl boronic acid,3,5-bis methoxycarbonyl benzeneboronic acid,1,3-benzenedicarboxylic acid, 5-borono-, 1,3-dimethyl ester,3,5-di methoxycarbonyl phenylboronic acid,acmc-1c6yh,3,5-bis methoxycarbonyl phenyl-dihydroxyborane PubChem CID: 19363104 IUPAC Name: [3,5-bis(methoxycarbonyl)phenyl]boronic acid SMILES: COC(=O)C1=CC(=CC(=C1)B(O)O)C(=O)OC

PubChem CID 19363104
CAS 177735-55-6
Molecular Weight (g/mol) 238.00
MDL Number MFCD11053854
SMILES COC(=O)C1=CC(=CC(=C1)B(O)O)C(=O)OC
Synonym 3,5-bis methoxycarbonyl phenylboronic acid,3,5-bis methoxycarbonyl phenyl boronic acid,3,5-bis methoxycarbonyl benzeneboronic acid,1,3-benzenedicarboxylic acid, 5-borono-, 1,3-dimethyl ester,3,5-di methoxycarbonyl phenylboronic acid,acmc-1c6yh,3,5-bis methoxycarbonyl phenyl-dihydroxyborane
IUPAC Name [3,5-bis(methoxycarbonyl)phenyl]boronic acid
InChI Key WEJWFDLAZSVCJK-UHFFFAOYSA-N
Molecular Formula C10H11BO6
32

Dimethyl aminoterephthalate, 99%

CAS: 5372-81-6 Molecular Formula: C10H11NO4 Molecular Weight (g/mol): 209.2 MDL Number: MFCD00008427 InChI Key: DSSKDXUDARIMTR-UHFFFAOYSA-N Synonym: dimethyl 2-aminoterephthalate,dimethyl aminoterephthalate,dimethyl 3-aminoterephthalate,1,4-benzenedicarboxylic acid, 2-amino-, dimethyl ester,aminoterephthalic acid dimethyl ester,1,4-dimethyl 2-aminobenzene-1,4-dicarboxylate,unii-91sf4e6i9w,2-aminoterephthalic acid, dimethyl ester,3-amino-4-methoxycarbonylbenzoic acid, methyl ester,terephthalic acid, amino-, dimethyl ester PubChem CID: 79336 IUPAC Name: dimethyl 2-aminobenzene-1,4-dicarboxylate SMILES: COC(=O)C1=CC(=C(C=C1)C(=O)OC)N

PubChem CID 79336
CAS 5372-81-6
Molecular Weight (g/mol) 209.2
MDL Number MFCD00008427
SMILES COC(=O)C1=CC(=C(C=C1)C(=O)OC)N
Synonym dimethyl 2-aminoterephthalate,dimethyl aminoterephthalate,dimethyl 3-aminoterephthalate,1,4-benzenedicarboxylic acid, 2-amino-, dimethyl ester,aminoterephthalic acid dimethyl ester,1,4-dimethyl 2-aminobenzene-1,4-dicarboxylate,unii-91sf4e6i9w,2-aminoterephthalic acid, dimethyl ester,3-amino-4-methoxycarbonylbenzoic acid, methyl ester,terephthalic acid, amino-, dimethyl ester
IUPAC Name dimethyl 2-aminobenzene-1,4-dicarboxylate
InChI Key DSSKDXUDARIMTR-UHFFFAOYSA-N
Molecular Formula C10H11NO4
33

mono-Methyl isophthalate, 97%

CAS: 1877-71-0 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00029972 InChI Key: WMZNGTSLFSJHMZ-UHFFFAOYSA-N Synonym: 3-methoxycarbonyl benzoic acid,mono-methyl isophthalate,methyl hydrogen isophthalate,isophthalic acid monomethyl ester,monomethyl isophthalate,isophthalic acid methyl ester,isophthalic acid, methyl ester,isophthalic acid, monomethyl ester,methyl m-phthalate,methyl 3-carboxybenzoate PubChem CID: 601880 IUPAC Name: 3-methoxycarbonylbenzoic acid SMILES: COC(=O)C1=CC=CC(=C1)C(=O)O

PubChem CID 601880
CAS 1877-71-0
Molecular Weight (g/mol) 180.16
MDL Number MFCD00029972
SMILES COC(=O)C1=CC=CC(=C1)C(=O)O
Synonym 3-methoxycarbonyl benzoic acid,mono-methyl isophthalate,methyl hydrogen isophthalate,isophthalic acid monomethyl ester,monomethyl isophthalate,isophthalic acid methyl ester,isophthalic acid, methyl ester,isophthalic acid, monomethyl ester,methyl m-phthalate,methyl 3-carboxybenzoate
IUPAC Name 3-methoxycarbonylbenzoic acid
InChI Key WMZNGTSLFSJHMZ-UHFFFAOYSA-N
Molecular Formula C9H8O4
34

Diethyl terephthalate, 98%

CAS: 636-09-9 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00039891 InChI Key: ONIHPYYWNBVMID-UHFFFAOYSA-N Synonym: diethyl terephthalate,p-diethyl phthalate,diethylterephthalate,terephthalic acid, diethyl ester,1,4-benzenedicarboxylic acid, diethyl ester,diethyl p-phthalate,terephthalic acid diethyl ester,unii-n97x85l3cd,1,4-diethyl benzene-1,4-dicarboxylate,1,4-benzenedicarboxylic acid, 1,4-diethyl ester PubChem CID: 12483 IUPAC Name: diethyl benzene-1,4-dicarboxylate SMILES: CCOC(=O)C1=CC=C(C=C1)C(=O)OCC

PubChem CID 12483
CAS 636-09-9
Molecular Weight (g/mol) 222.24
MDL Number MFCD00039891
SMILES CCOC(=O)C1=CC=C(C=C1)C(=O)OCC
Synonym diethyl terephthalate,p-diethyl phthalate,diethylterephthalate,terephthalic acid, diethyl ester,1,4-benzenedicarboxylic acid, diethyl ester,diethyl p-phthalate,terephthalic acid diethyl ester,unii-n97x85l3cd,1,4-diethyl benzene-1,4-dicarboxylate,1,4-benzenedicarboxylic acid, 1,4-diethyl ester
IUPAC Name diethyl benzene-1,4-dicarboxylate
InChI Key ONIHPYYWNBVMID-UHFFFAOYSA-N
Molecular Formula C12H14O4
35

Thermo Scientific Chemicals 6-Carboxyfluorescein, 96%

CAS: 3301-79-9 Molecular Formula: C21H12O7 Molecular Weight (g/mol): 376.32 MDL Number: MFCD00036873 InChI Key: BZTDTCNHAFUJOG-UHFFFAOYSA-N Synonym: 6-carboxyfluorescein,6-fam,carboxyfluorescein,spiro isobenzofuran-1 3h ,9'-9h xanthene-6-carboxylic acid, 3',6'-dihydroxy-3-oxo,3,6,9-trihydroxyxanthen-9-yl terephthalic acid,3',6'-dihydroxy-3-oxo-3h-spiro 2-benzofuran-1,9'-xanthene-6-carboxylic acid,3',6'-dihydroxy-3-oxo-3h-spiro isobenzofuran-1,9'-xanthene-6-carboxylic acid,5 6-carboxy fluorescein,bidd:gt0504 PubChem CID: 76806 ChEBI: CHEBI:39073 IUPAC Name: 3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylic acid SMILES: C1=CC2=C(C=C1C(=O)O)C3(C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)OC2=O

PubChem CID 76806
CAS 3301-79-9
Molecular Weight (g/mol) 376.32
ChEBI CHEBI:39073
MDL Number MFCD00036873
SMILES C1=CC2=C(C=C1C(=O)O)C3(C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)OC2=O
Synonym 6-carboxyfluorescein,6-fam,carboxyfluorescein,spiro isobenzofuran-1 3h ,9'-9h xanthene-6-carboxylic acid, 3',6'-dihydroxy-3-oxo,3,6,9-trihydroxyxanthen-9-yl terephthalic acid,3',6'-dihydroxy-3-oxo-3h-spiro 2-benzofuran-1,9'-xanthene-6-carboxylic acid,3',6'-dihydroxy-3-oxo-3h-spiro isobenzofuran-1,9'-xanthene-6-carboxylic acid,5 6-carboxy fluorescein,bidd:gt0504
IUPAC Name 3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxylic acid
InChI Key BZTDTCNHAFUJOG-UHFFFAOYSA-N
Molecular Formula C21H12O7
36

Terephthalic Acid 99.0+%, TCI America™

CAS: 100-21-0 Molecular Formula: C8H6O4 Molecular Weight (g/mol): 166.132 MDL Number: MFCD00002558 InChI Key: KKEYFWRCBNTPAC-UHFFFAOYSA-N Synonym: p-phthalic acid,1,4-benzenedicarboxylic acid,benzene-1,4-dicarboxylic acid,p-dicarboxybenzene,p-benzenedicarboxylic acid,p-carboxybenzoic acid,acide terephtalique,para-phthalic acid,tephthol,1,4-dicarboxybenzene PubChem CID: 7489 ChEBI: CHEBI:15702 IUPAC Name: terephthalic acid SMILES: C1=CC(=CC=C1C(=O)O)C(=O)O

PubChem CID 7489
CAS 100-21-0
Molecular Weight (g/mol) 166.132
ChEBI CHEBI:15702
MDL Number MFCD00002558
SMILES C1=CC(=CC=C1C(=O)O)C(=O)O
Synonym p-phthalic acid,1,4-benzenedicarboxylic acid,benzene-1,4-dicarboxylic acid,p-dicarboxybenzene,p-benzenedicarboxylic acid,p-carboxybenzoic acid,acide terephtalique,para-phthalic acid,tephthol,1,4-dicarboxybenzene
IUPAC Name terephthalic acid
InChI Key KKEYFWRCBNTPAC-UHFFFAOYSA-N
Molecular Formula C8H6O4
37

Dimethyl 4-Hydroxyisophthalate 97.0+%, TCI America™

CAS: 5985-24-0 Molecular Formula: C10H10O5 Molecular Weight (g/mol): 210.185 MDL Number: MFCD00152444 InChI Key: ALBUJVBOIXVVLS-UHFFFAOYSA-N Synonym: 4-Hydroxyisophthalic Acid Dimethyl Ester PubChem CID: 80087 IUPAC Name: dimethyl 4-hydroxybenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=C(C=C1)O)C(=O)OC

PubChem CID 80087
CAS 5985-24-0
Molecular Weight (g/mol) 210.185
MDL Number MFCD00152444
SMILES COC(=O)C1=CC(=C(C=C1)O)C(=O)OC
Synonym 4-Hydroxyisophthalic Acid Dimethyl Ester
IUPAC Name dimethyl 4-hydroxybenzene-1,3-dicarboxylate
InChI Key ALBUJVBOIXVVLS-UHFFFAOYSA-N
Molecular Formula C10H10O5
38

2-Hydroxyterephthalic Acid 98.0+%, TCI America™

CAS: 636-94-2 Molecular Formula: C8H6O5 Molecular Weight (g/mol): 182.131 MDL Number: MFCD09835368 InChI Key: CDOWNLMZVKJRSC-UHFFFAOYSA-N PubChem CID: 97257 IUPAC Name: 2-hydroxyterephthalic acid SMILES: C1=CC(=C(C=C1C(=O)O)O)C(=O)O

PubChem CID 97257
CAS 636-94-2
Molecular Weight (g/mol) 182.131
MDL Number MFCD09835368
SMILES C1=CC(=C(C=C1C(=O)O)O)C(=O)O
IUPAC Name 2-hydroxyterephthalic acid
InChI Key CDOWNLMZVKJRSC-UHFFFAOYSA-N
Molecular Formula C8H6O5
39

2,5-Dihydroxyterephthalic Acid 98.0+%, TCI America™

CAS: 610-92-4 Molecular Formula: C8H6O6 Molecular Weight (g/mol): 198.13 MDL Number: MFCD00132933 InChI Key: OYFRNYNHAZOYNF-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxylic acid, 2,5-dihydroxy,2,5-dihydroxyterephthalicacid,2,5-dihydroxy-1,4-benzenedicarboxylic acid,2,5-dihydroxybenzene-1,4-dicarboxylic acid,zlchem 699,acmc-1ayqi,1, 2,5-dihydroxy,2,5-dihydroxytelephthalic acid,#,2,5-dihydroxyterephthalic acid PubChem CID: 69131 IUPAC Name: 2,5-dihydroxyterephthalic acid SMILES: C1=C(C(=CC(=C1O)C(=O)O)O)C(=O)O

PubChem CID 69131
CAS 610-92-4
Molecular Weight (g/mol) 198.13
MDL Number MFCD00132933
SMILES C1=C(C(=CC(=C1O)C(=O)O)O)C(=O)O
Synonym 1,4-benzenedicarboxylic acid, 2,5-dihydroxy,2,5-dihydroxyterephthalicacid,2,5-dihydroxy-1,4-benzenedicarboxylic acid,2,5-dihydroxybenzene-1,4-dicarboxylic acid,zlchem 699,acmc-1ayqi,1, 2,5-dihydroxy,2,5-dihydroxytelephthalic acid,#,2,5-dihydroxyterephthalic acid
IUPAC Name 2,5-dihydroxyterephthalic acid
InChI Key OYFRNYNHAZOYNF-UHFFFAOYSA-N
Molecular Formula C8H6O6
40

Tetrafluoroterephthalic Acid 97.0+%, TCI America™

CAS: 652-36-8 Molecular Formula: C8H2F4O4 Molecular Weight (g/mol): 238.09 MDL Number: MFCD00012301 InChI Key: WFNRNCNCXRGUKN-UHFFFAOYSA-N PubChem CID: 69549 IUPAC Name: tetrafluorobenzene-1,4-dicarboxylic acid SMILES: OC(=O)C1=C(F)C(F)=C(C(O)=O)C(F)=C1F

PubChem CID 69549
CAS 652-36-8
Molecular Weight (g/mol) 238.09
MDL Number MFCD00012301
SMILES OC(=O)C1=C(F)C(F)=C(C(O)=O)C(F)=C1F
IUPAC Name tetrafluorobenzene-1,4-dicarboxylic acid
InChI Key WFNRNCNCXRGUKN-UHFFFAOYSA-N
Molecular Formula C8H2F4O4
41

Monomethyl 5-Nitroisophthalate 98.0+%, TCI America™

CAS: 1955-46-0 Molecular Formula: C9H7NO6 Molecular Weight (g/mol): 225.156 MDL Number: MFCD00009793 InChI Key: ZCRNIIJXDRYWDU-UHFFFAOYSA-N Synonym: 3-methoxycarbonyl-5-nitrobenzoic acid,5-nitroisophthalic acid monomethyl ester,monomethyl 5-nitroisophthalate,methyl 5-nitroisophthalate,mono-methyl 5-nitroisophthalate,mono-methyl-5-nitroisophthalic acid,methyl hydrogen 5-nitroisophthalate,5-nitroisophthalic acid, monomethyl ester,monomethyl-5-nitroisophthalate,monomethyl 5-nitrobenzene-1,3-dicarboxylate PubChem CID: 74776 SMILES: COC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]

PubChem CID 74776
CAS 1955-46-0
Molecular Weight (g/mol) 225.156
MDL Number MFCD00009793
SMILES COC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]
Synonym 3-methoxycarbonyl-5-nitrobenzoic acid,5-nitroisophthalic acid monomethyl ester,monomethyl 5-nitroisophthalate,methyl 5-nitroisophthalate,mono-methyl 5-nitroisophthalate,mono-methyl-5-nitroisophthalic acid,methyl hydrogen 5-nitroisophthalate,5-nitroisophthalic acid, monomethyl ester,monomethyl-5-nitroisophthalate,monomethyl 5-nitrobenzene-1,3-dicarboxylate
InChI Key ZCRNIIJXDRYWDU-UHFFFAOYSA-N
Molecular Formula C9H7NO6
42

Monoethyl 5-Nitroisophthalate 98.0+%, TCI America™

CAS: 22871-55-2 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.183 MDL Number: MFCD00130051 InChI Key: HOYHBDFTELAGGG-UHFFFAOYSA-N Synonym: 5-Nitroisophthalic Acid Monoethyl Ester PubChem CID: 89872 IUPAC Name: 3-ethoxycarbonyl-5-nitrobenzoic acid SMILES: CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]

PubChem CID 89872
CAS 22871-55-2
Molecular Weight (g/mol) 239.183
MDL Number MFCD00130051
SMILES CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]
Synonym 5-Nitroisophthalic Acid Monoethyl Ester
IUPAC Name 3-ethoxycarbonyl-5-nitrobenzoic acid
InChI Key HOYHBDFTELAGGG-UHFFFAOYSA-N
Molecular Formula C10H9NO6
43

Diallyl Terephthalate 98.0+%, TCI America™

CAS: 1026-92-2 Molecular Formula: C14H14O4 Molecular Weight (g/mol): 246.262 MDL Number: MFCD00080462 InChI Key: ZDNFTNPFYCKVTB-UHFFFAOYSA-N Synonym: Terephthalic Acid Diallyl Ester PubChem CID: 66102 IUPAC Name: bis(prop-2-enyl) benzene-1,4-dicarboxylate SMILES: C=CCOC(=O)C1=CC=C(C=C1)C(=O)OCC=C

PubChem CID 66102
CAS 1026-92-2
Molecular Weight (g/mol) 246.262
MDL Number MFCD00080462
SMILES C=CCOC(=O)C1=CC=C(C=C1)C(=O)OCC=C
Synonym Terephthalic Acid Diallyl Ester
IUPAC Name bis(prop-2-enyl) benzene-1,4-dicarboxylate
InChI Key ZDNFTNPFYCKVTB-UHFFFAOYSA-N
Molecular Formula C14H14O4
44

Dimethyl 5-Hydroxyisophthalate 98.0+%, TCI America™

CAS: 13036-02-7 Molecular Formula: C10H10O5 Molecular Weight (g/mol): 210.19 MDL Number: MFCD00134367 InChI Key: DOSDTCPDBPRFHQ-UHFFFAOYSA-N PubChem CID: 83065 IUPAC Name: 1,3-dimethyl 5-hydroxybenzene-1,3-dicarboxylate SMILES: COC(=O)C1=CC(=CC(O)=C1)C(=O)OC

PubChem CID 83065
CAS 13036-02-7
Molecular Weight (g/mol) 210.19
MDL Number MFCD00134367
SMILES COC(=O)C1=CC(=CC(O)=C1)C(=O)OC
IUPAC Name 1,3-dimethyl 5-hydroxybenzene-1,3-dicarboxylate
InChI Key DOSDTCPDBPRFHQ-UHFFFAOYSA-N
Molecular Formula C10H10O5
45

Dimethyl Bromoterephthalate 98.0+%, TCI America™

CAS: 18643-86-2 Molecular Formula: C10H9BrO4 Molecular Weight (g/mol): 273.082 MDL Number: MFCD00060638 InChI Key: VUMPFOPENBVFOF-UHFFFAOYSA-N Synonym: Bromoterephthalic Acid Dimethyl Ester PubChem CID: 87741 IUPAC Name: dimethyl 2-bromobenzene-1,4-dicarboxylate SMILES: COC(=O)C1=CC(=C(C=C1)C(=O)OC)Br

PubChem CID 87741
CAS 18643-86-2
Molecular Weight (g/mol) 273.082
MDL Number MFCD00060638
SMILES COC(=O)C1=CC(=C(C=C1)C(=O)OC)Br
Synonym Bromoterephthalic Acid Dimethyl Ester
IUPAC Name dimethyl 2-bromobenzene-1,4-dicarboxylate
InChI Key VUMPFOPENBVFOF-UHFFFAOYSA-N
Molecular Formula C10H9BrO4