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Phthalate esters
Description:
Ester derivatives of phthalic acids, which are based on a benzene dicarboxylic acid skeleton.
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3,5-Bis(methoxycarbonyl)phenylboronic acid(contains varying amounts of Anhydride)Cas Number: 177735-55-6Formula: C10H11BO6 Molecular Weight: 238IUPAC Name: [3,5-bis(methoxycarbonyl)phenyl]boronic acidSMILES: B(C1=CC(=CC(=C1)C(=O)OC)C(=O)OC)(O)OInChIKey: WEJWFDLAZSVCJK-UHFFFAOYSA-NInChI: InChI=1S/C10H11BO6/c1-16-9(12)6-3-7(10(13)17-2)5-8(4-6)11(14)15/h3-5,14-15H,1-2H3Synonyms: 177735-55-6|3,5-Bis(methoxycarbonyl)phenylboronic acid|(3,5-Bis(methoxycarbonyl)phenyl)boronic acid|[3,5-Bis(methoxyc... -
2-fluoro-3-(methoxycarbonyl)benzoic acidCas Number: 914301-44-3Formula: C9H7FO4 Molecular Weight: 198.149IUPAC Name: 2-fluoro-3-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=CC=CC(=C1F)C(=O)OInChIKey: GHBSBSSHCNIRTB-UHFFFAOYSA-NInChI: InChI=1S/C9H7FO4/c1-14-9(13)6-4-2-3-5(7(6)10)8(11)12/h2-4H,1H3,(H,11,12)Synonyms: 2-Fluoro-3-(methoxycarbonyl)benzoic acid|914301-44-3|2-fluoro-3-methoxycarbonylbenzoic acid|1,3-BENZENEDICARBOXYLIC A... -
2-Amino-4-(methoxycarbonyl)benzoic acidCas Number: 85743-02-8Formula: C9H9NO4 Molecular Weight: 195.17IUPAC Name: 2-amino-4-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=CC(=C(C=C1)C(=O)O)NInChIKey: WOLYDIFKLNALLS-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO4/c1-14-9(13)5-2-3-6(8(11)12)7(10)4-5/h2-4H,10H2,1H3,(H,11,12)Synonyms: 2-Amino-4-methoxycarbonyl benzoic acid | methyl 3-amino-4-carboxybenzoate | 2-Carboxy-5-(methoxycarbonyl)aniline | MF... -
2,4-Bis(Methoxycarbonyl)phenylboronic acidCas Number: 1256354-98-9Formula: C10H11BO6 Molecular Weight: 238IUPAC Name: [2,4-bis(methoxycarbonyl)phenyl]boronic acidSMILES: B(C1=C(C=C(C=C1)C(=O)OC)C(=O)OC)(O)OInChIKey: BUXKKSVFGRKVGD-UHFFFAOYSA-NInChI: InChI=1S/C10H11BO6/c1-16-9(12)6-3-4-8(11(14)15)7(5-6)10(13)17-2/h3-5,14-15H,1-2H3Synonyms: 1256354-98-9|(2,4-Bis(methoxycarbonyl)phenyl)boronic acid|2,4-BIS(METHOXYCARBONYL)PHENYLBORONIC ACID|[2,4-bis(methoxy...
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1-Methyl 2-nitroterephthalateCas Number: 35092-89-8Formula: C9H7NO6 Molecular Weight: 225.15IUPAC Name: 4-methoxycarbonyl-3-nitrobenzoic acidSMILES: COC(=O)C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]InChIKey: MIIADZYPHVTLPR-UHFFFAOYSA-NInChI: InChI=1S/C9H7NO6/c1-16-9(13)6-3-2-5(8(11)12)4-7(6)10(14)15/h2-4H,1H3,(H,11,12)Synonyms: 35092-89-8|4-(methoxycarbonyl)-3-nitrobenzoic acid|1-Methyl 2-nitroterephthalate|4-methoxycarbonyl-3-nitrobenzoic aci...
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1-Methyl 2-AminoterephthalateCas Number: 60728-41-8Formula: C9H9NO4 Molecular Weight: 195.17IUPAC Name: 3-amino-4-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=C(C=C(C=C1)C(=O)O)NInChIKey: QKOKLMFCKLEFDV-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO4/c1-14-9(13)6-3-2-5(8(11)12)4-7(6)10/h2-4H,10H2,1H3,(H,11,12)Synonyms: 3-amino-4-(methoxycarbonyl)benzoic acid | FT-0608017 | 2-amino-terephthalic acid 1-methyl ester | 2-Aminoterephthalic...
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4-Hydroxy-3-(methoxycarbonyl)benzoic acidCas Number: 41684-11-1Formula: C9H8O5 Molecular Weight: 196.16IUPAC Name: 4-hydroxy-3-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=C(C=CC(=C1)C(=O)O)OInChIKey: JDUYMWSYTIJMJO-UHFFFAOYSA-NInChI: InChI=1S/C9H8O5/c1-14-9(13)6-4-5(8(11)12)2-3-7(6)10/h2-4,10H,1H3,(H,11,12)
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4-(tert-Butoxycarbonyl)benzoic acidCas Number: 20576-82-3 Compound CID: 2760954Formula: C12H14O4 Molecular Weight: 222.24IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonyl]benzoic acidSMILES: CC(C)(C)OC(=O)C1=CC=C(C=C1)C(=O)OInChIKey: ILBDCOLCHNVWNS-UHFFFAOYSA-NInChI: InChI=1S/C12H14O4/c1-12(2,3)16-11(15)9-6-4-8(5-7-9)10(13)14/h4-7H,1-3H3,(H,13,14)Synonyms: 4-(tert-Butoxycarbonyl)benzoic acid | 4-[(tert-butoxy)carbonyl]benzoic acid | SCHEMBL527251 | 1,4-Benzenedicarboxylic...
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Methyl 2-amino-3-carboxybenzoateCas Number: 253120-47-7Formula: C9H9NO4 Molecular Weight: 195.17IUPAC Name: 2-amino-3-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=CC=CC(=C1N)C(=O)OInChIKey: UXQCFHRNRAGKOY-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO4/c1-14-9(13)6-4-2-3-5(7(6)10)8(11)12/h2-4H,10H2,1H3,(H,11,12)Synonyms: DS-0780 | W-206946 | AM807372 | 2-Aminoisophthalic acid monomethyl ester | 2-AMINO-ISOPHTHALIC ACID MONOMETHYL ESTER ...
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Dimethyl 2-methyl-1,4-phthalateCas Number: 14186-60-8Formula: C11H12O4 Molecular Weight: 208.21IUPAC Name: dimethyl 2-methylbenzene-1,4-dicarboxylateSMILES: CC1=C(C=CC(=C1)C(=O)OC)C(=O)OCInChIKey: DXIRJLBDSXBZCS-UHFFFAOYSA-NInChI: InChI=1S/C11H12O4/c1-7-6-8(10(12)14-2)4-5-9(7)11(13)15-3/h4-6H,1-3H3Synonyms: SCHEMBL45823 | MFCD11502730 | A807821 | CS-0111067 | Dimethyl 2-methylterephthalate | dimethyl-2-methylterephthalate ...
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2-Bromomethyl-terephthalic acid dimethyl esterCas Number: 57834-13-6Formula: C11H11BrO4 Molecular Weight: 287.11IUPAC Name: dimethyl 2-(bromomethyl)benzene-1,4-dicarboxylateSMILES: COC(=O)C1=CC(=C(C=C1)C(=O)OC)CBrInChIKey: UTIKNGRWJJKNBJ-UHFFFAOYSA-NInChI: InChI=1S/C11H11BrO4/c1-15-10(13)7-3-4-9(11(14)16-2)8(5-7)6-12/h3-5H,6H2,1-2H3Synonyms: DIMETHYL 2-(BROMOMETHYL)TEREPHTHALATE | dimethyl-2-bromomethylterephthalate | SCHEMBL11601201 | 2-(Bromomethyl)-1,4-b...
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1,3-dimethyl 2-aminobenzene-1,3-dicarboxylateCas Number: 57053-02-8Formula: C10H11NO4 Molecular Weight: 209.1986IUPAC Name: dimethyl 2-aminobenzene-1,3-dicarboxylateSMILES: COC(=O)C1=C(C(=CC=C1)C(=O)OC)NInChIKey: QVBQPOJYBWWILD-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO4/c1-14-9(12)6-4-3-5-7(8(6)11)10(13)15-2/h3-5H,11H2,1-2H3Synonyms: dimethyl 2-aminoisophthalate|57053-02-8|1,3-dimethyl 2-aminobenzene-1,3-dicarboxylate|dimethyl 2-aminobenzene-1,3-dic...
