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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-Fluoro-4-(methoxycarbonyl)benzoic acidCas Number: 161796-11-8Formula: C9H7FO4 Molecular Weight: 198.15IUPAC Name: 3-fluoro-4-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=C(C=C(C=C1)C(=O)O)FInChIKey: BHCZVQVKEQQOAN-UHFFFAOYSA-NInChI: InChI=1S/C9H7FO4/c1-14-9(13)6-3-2-5(8(11)12)4-7(6)10/h2-4H,1H3,(H,11,12)Synonyms: Z1262515384 | BHCZVQVKEQQOAN-UHFFFAOYSA-N | 2-Fluoroterephthalic acid 1-methyl ester | A929565 | EN300-112535 | SCHEM... -
Dimethyl 2,5-dihydroxyterephthalateCas Number: 5870-37-1 EC Number: ‘807-699-9Formula: C10H10O6 Molecular Weight: 226.18IUPAC Name: dimethyl 2,5-dihydroxybenzene-1,4-dicarboxylateSMILES: COC(=O)C1=CC(=C(C=C1O)C(=O)OC)OInChIKey: WABMHCVYKWKAAH-UHFFFAOYSA-NInChI: InChI=1S/C10H10O6/c1-15-9(13)5-3-8(12)6(4-7(5)11)10(14)16-2/h3-4,11-12H,1-2H3Synonyms: Dimethyl 2,5-dihydroxybenzene-1,4-dicarboxylate | 1,4-Benzenedicarboxylic acid, 2,5-dihydroxy-, dimethyl ester | 1,4-...
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Dimethyl 2-bromoisophthalateCas Number: 39622-80-5Formula: C10H9BrO4 Molecular Weight: 273.08IUPAC Name: dimethyl 2-bromobenzene-1,3-dicarboxylateSMILES: COC(=O)C1=C(C(=CC=C1)C(=O)OC)BrInChIKey: GHPOMFOMBISJGM-UHFFFAOYSA-NInChI: InChI=1S/C10H9BrO4/c1-14-9(12)6-4-3-5-7(8(6)11)10(13)15-2/h3-5H,1-2H3Synonyms: A24324 | 2-bromoisophthalic acid dimethyl ester | 2-bromo-isophthalic acid dimethyl ester | SCHEMBL987813 | 2-Bromo-1...
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Methyl 1-oxo-1,3-dihydroisobenzofuran-5-carboxylateCas Number: 23405-32-5Formula: C10H8O4 Molecular Weight: 192.17IUPAC Name: methyl 1-oxo-3H-2-benzofuran-5-carboxylateSMILES: COC(=O)C1=CC2=C(C=C1)C(=O)OC2InChIKey: DEVJBGUKNZVBFW-UHFFFAOYSA-NInChI: InChI=1S/C10H8O4/c1-13-9(11)6-2-3-8-7(4-6)5-14-10(8)12/h2-4H,5H2,1H3Synonyms: Methyl1-oxo-1,3-dihydroisobenzofuran-5-carboxylate | Methyl 1-oxo-1,3-dihydroisobenzofuran-5-carboxylate | SCHEMBL302...
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Dimethyl 5-formylisophthalateCas Number: 164073-80-7Formula: C11H10O5 Molecular Weight: 222.19IUPAC Name: dimethyl 5-formylbenzene-1,3-dicarboxylateSMILES: COC(=O)C1=CC(=CC(=C1)C=O)C(=O)OCInChIKey: CNOSLEHLXKSKSH-UHFFFAOYSA-NInChI: InChI=1S/C11H10O5/c1-15-10(13)8-3-7(6-12)4-9(5-8)11(14)16-2/h3-6H,1-2H3
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Diethyl 5-(hydroxymethyl)isophthalateCas Number: 181425-91-2Formula: C13H16O5 Molecular Weight: 252.26IUPAC Name: diethyl 5-(hydroxymethyl)benzene-1,3-dicarboxylateSMILES: CCOC(=O)C1=CC(=CC(=C1)CO)C(=O)OCCInChIKey: AMRPMZYDTZVKTP-UHFFFAOYSA-NInChI: InChI=1S/C13H16O5/c1-3-17-12(15)10-5-9(8-14)6-11(7-10)13(16)18-4-2/h5-7,14H,3-4,8H2,1-2H3Synonyms: DTXSID70346169 | IDI1_012047 | AKOS015894355 | J-011582 | diethyl 5-(hydroxymethyl)benzene-1,3-dioate | 1,3-Benzenedi...
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Diethyl 2,5-dihydroxyterephthalateCas Number: 5870-38-2Formula: C12H14O6 Molecular Weight: 254.24IUPAC Name: diethyl 2,5-dihydroxybenzene-1,4-dicarboxylateSMILES: CCOC(=O)C1=CC(=C(C=C1O)C(=O)OCC)OInChIKey: UQOUOXLHXPHDHF-UHFFFAOYSA-NInChI: InChI=1S/C12H14O6/c1-3-17-11(15)7-5-10(14)8(6-9(7)13)12(16)18-4-2/h5-6,13-14H,3-4H2,1-2H3Synonyms: EINECS 227-522-3 | 2,5-dihydroxy terephthalic acid diethyl ester | MFCD00055430 | Terephthalic acid,5-dihydroxy-, die...
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1-Methyl 2-iodoterephthalateCas Number: 299173-24-3Formula: C9H7IO4 Molecular Weight: 306.06IUPAC Name: 3-iodo-4-methoxycarbonylbenzoic acidSMILES: COC(=O)C1=C(C=C(C=C1)C(=O)O)IInChIKey: AGYGRJJIWDNTLI-UHFFFAOYSA-NInChI: InChI=1S/C9H7IO4/c1-14-9(13)6-3-2-5(8(11)12)4-7(6)10/h2-4H,1H3,(H,11,12)Synonyms: 1-Methyl 2-iodoterephthalate | ZLA17324 | A876357 | 2-Iodo-terephthalic acid 1-methyl ester | 1-Methyl 2-iodoterephth...
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Mono(2-ethylhexyl) TerephthalateCas Number: 155603-50-2Formula: C16H22O4 Molecular Weight: 278.34IUPAC Name: 4-(2-ethylhexoxycarbonyl)benzoic acidSMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)C(=O)OInChIKey: HRUJAEJKCNCOGW-UHFFFAOYSA-NInChI: InChI=1S/C16H22O4/c1-3-5-6-12(4-2)11-20-16(19)14-9-7-13(8-10-14)15(17)18/h7-10,12H,3-6,11H2,1-2H3,(H,17,18)Synonyms: SY114920 | FT-0699429 | 4-(((2-Ethylhexyl)oxy)carbonyl)benzoicacid | A883639 | CHEBI:165208 | MRK5E97B18 | AKOS024262...
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Dimethyl terephthalateCas Number: 120-61-6 EC Number: 204-411-8Formula: C10H10O4 Molecular Weight: 194.18IUPAC Name: dimethyl benzene-1,4-dicarboxylateSMILES: COC(=O)C1=CC=C(C=C1)C(=O)OCInChIKey: WOZVHXUHUFLZGK-UHFFFAOYSA-NInChI: InChI=1S/C10H10O4/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-6H,1-2H3Synonyms: DIMETHYL TEREPHTHALATE|120-61-6|Dimethyl p-phthalate|1,4-Benzenedicarboxylic acid, dimethyl ester|Dimethyl 4-phthalat...
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Dimethyl 4-HydroxyisophthalateCas Number: 5985-24-0Formula: C10H10O5 Molecular Weight: 210.19IUPAC Name: dimethyl 4-hydroxybenzene-1,3-dicarboxylateSMILES: COC(=O)C1=CC(=C(C=C1)O)C(=O)OCInChIKey: ALBUJVBOIXVVLS-UHFFFAOYSA-NInChI: InChI=1S/C10H10O5/c1-14-9(12)6-3-4-8(11)7(5-6)10(13)15-2/h3-5,11H,1-2H3Synonyms: Dimethyl 4-hydroxyisophthalate|5985-24-0|4-Hydroxyisophthalic acid dimethyl ester|4-Hydroxy-isophthalic acid dimethyl...
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Dimethyl 5-chloroisophthalateCas Number: 20330-90-9Formula: C10H9ClO4 Molecular Weight: 228.63IUPAC Name: dimethyl 5-chlorobenzene-1,3-dicarboxylateSMILES: COC(=O)C1=CC(=CC(=C1)Cl)C(=O)OCInChIKey: CMMPMNSOVLQGMJ-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClO4/c1-14-9(12)6-3-7(10(13)15-2)5-8(11)4-6/h3-5H,1-2H3Synonyms: DTXSID10279740 | SY027453 | 1,3-Benzenedicarboxylic acid, 5-chloro-, 1,3-dimethyl ester | CK1105 | 5-chloro-2,4-dimet...
