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Benzoic acid esters
Description:
Ester derivatives of benzoic acid.
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Dihexadecyl phthalateCas Number: 13372-18-4Formula: C40H70O4 Molecular Weight: 614.9814SMILES: CCCCCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCInChIKey: WKXCGJKBBBBNPF-UHFFFAOYSA-NInChI: show more -
Dialkyl Phthalate (Alkyl= Heptyl:Heptyl， Nonyl:Nonyl， Undecyl:Undecyl， Heptyl:Nonyl， Heptyl:Undecyl， Nonyl:Undecyl)Cas Number: 68515-42-4 Compound CID: 6423795Formula: C8H4O4+(CₓH2ₓ₊1) Molecular Weight: 362.5041861IUPAC Name: 1-O-heptyl 2-O-undecyl benzene-1,2-dicarboxylateSMILES: CCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCInChIKey: ILVKYQKHSCWQAW-UHFFFAOYSA-NInChI: InChI=1S/C26H42O4/c1-3-5-7-9-10-11-12-14-18-22-30-26(28)24-20-16-15-19-23(24)25(27)29-21-17-13-8-6-4-2/h15-16,19-20H,3-14,17-18,21-22H2,1-2H3
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Benzoic acid， 2-hydroxy-， 2-butyloctyl esterCas Number: 190085-41-7Formula: C19H30O3 Molecular Weight: 306.4397SMILES: CCCCCCC(CCCC)COC(=O)C1=CC=CC=C1OInChIKey: CZVOIAOPRGNENY-UHFFFAOYSA-NInChI: InChI=1S/C19H30O3/c1-3-5-7-8-12-16(11-6-4-2)15-22-19(21)17-13-9-10-14-18(17)20/h9-10,13-14,16,20H,3-8,11-12,15H2,1-2H3
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Benzyl Butyl Phthalate-d4Cas Number: 93951-88-3 Compound CID: 16213880Formula: 19H16D4O4IUPAC Name: 2-O-benzyl 1-O-butyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylateSMILES: CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2InChIKey: IRIAEXORFWYRCZ-CXRURWBMSA-NInChI: InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3/i7D,8D,11D,12D
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Benzoic acid， 4-(3-hydroxypropyl)-， methyl esterCas Number: 15403-22-2Formula: C11H14O3 Molecular Weight: 194.2271SMILES: COC(=O)C1=CC=C(C=C1)CCCOInChIKey: ARNGRGQYXABYAT-UHFFFAOYSA-NInChI: InChI=1S/C11H14O3/c1-14-11(13)10-6-4-9(5-7-10)3-2-8-12/h4-7,12H,2-3,8H2,1H3
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2-hydroxyethyl 4-methylbenzoateCas Number: 28129-15-9Formula: C10H12O3 Molecular Weight: 180.20048SMILES: CC1=CC=C(C=C1)C(=O)OCCOInChIKey: BOMBRBNKVUKCJW-UHFFFAOYSA-NInChI: InChI=1S/C10H12O3/c1-8-2-4-9(5-3-8)10(12)13-7-6-11/h2-5,11H,6-7H2,1H3
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2-(Chloromethyl)phenethyl benzoateCas Number: 168476-58-2Formula: C16H15ClO2 Molecular Weight: 274.74SMILES: C1=CC=C(C=C1)C(=O)OCCC2=CC=CC=C2CClInChIKey: ROPIKNICZPOGML-UHFFFAOYSA-NInChI: InChI=1S/C16H15ClO2/c17-12-15-9-5-4-6-13(15)10-11-19-16(18)14-7-2-1-3-8-14/h1-9H,10-12H2
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1，2-Propanediol， 1，2-dibenzoateCas Number: 19224-26-1Formula: C17H16O4 Molecular Weight: 284.3065SMILES: CC(COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2InChIKey: UMVMVEZHMZTUHD-UHFFFAOYSA-NInChI: InChI=1S/C17H16O4/c1-13(21-17(19)15-10-6-3-7-11-15)12-20-16(18)14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
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1，2，4-Benzenetris(carboxylic acid ethyl) esterCas Number: 14230-18-3Formula: C15H18O6 Molecular Weight: 294.3SMILES: CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)C(=O)OCCInChIKey: NGXQRWJDOKUJEN-UHFFFAOYSA-NInChI: InChI=1S/C15H18O6/c1-4-19-13(16)10-7-8-11(14(17)20-5-2)12(9-10)15(18)21-6-3/h7-9H,4-6H2,1-3H3
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1，2-Benzenedicarboxylic acid， 1-(2-methoxyethyl) esterCas Number: 16501-01-2Formula: C11H11O5 Molecular Weight: 223.202SMILES: COCCOC(=O)C1=CC=CC=C1C(=O)OInChIKey: NGFWAKGWMSOVMP-UHFFFAOYSA-NInChI: InChI=1S/C11H12O5/c1-15-6-7-16-11(14)9-5-3-2-4-8(9)10(12)13/h2-5H,6-7H2,1H3,(H,12,13)
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(2S，3R，5R)-5-Chloro-2-(((4-methylbenzoyl)oxy)-methyl)tetrahydrofuran-3-yl 4-methylbenzoateCas Number: 141846-57-3 Compound CID: 66548352Formula: C21H21ClO5 Molecular Weight: 388.85IUPAC Name: [(2S,3R,5R)-5-chloro-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoateSMILES: CC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)Cl)OC(=O)C3=CC=C(C=C3)CInChIKey: FJHSYOMVMMNQJQ-QYZOEREBSA-NInChI: InChI=1S/C21H21ClO5/c1-13-3-7-15(8-4-13)20(23)25-12-18-17(11-19(22)26-18)27-21(24)16-9-5-14(2)6-10-16/h3-10,17-19H,11-12H2,1-2H3/t17-,18+,19+/m1/s1
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Methyl 4-((4-formylphenoxy)methyl)benzoateCas Number: 124663-30-5 Compound CID: 877931Formula: C16H14O4 Molecular Weight: 270.27IUPAC Name: methyl 4-[(4-formylphenoxy)methyl]benzoateSMILES: COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=OInChIKey: QCMBUFDXULESGG-UHFFFAOYSA-NInChI: InChI=1S/C16H14O4/c1-19-16(18)14-6-2-13(3-7-14)11-20-15-8-4-12(10-17)5-9-15/h2-10H,11H2,1H3
