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Benzoic acid esters
Description:
Ester derivatives of benzoic acid.
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2-(2'，3'，5'-triiodobenzoyl)ethyl methacrylateCas Number: 161042-10-0 Compound CID: 127920IUPAC Name: 2-(2-methylprop-2-enoyloxy)ethyl 2,3,5-triiodobenzoateSMILES: CC(=C)C(=O)OCCOC(=O)C1=C(C(=CC(=C1)I)I)IInChIKey: NULXFDVOMMITJV-UHFFFAOYSA-NInChI: InChI=1S/C13H11I3O4/c1-7(2)12(17)19-3-4-20-13(18)9-5-8(14)6-10(15)11(9)16/h5-6H,1,3-4H2,2H3 -
propane-1，3-diyl dibenzoateCas Number: 2451-86-7Formula: C17H16O4 Molecular Weight: 284.3065SMILES: C1=CC=C(C=C1)C(=O)OCCCOC(=O)C2=CC=CC=C2InChIKey: SSEOOCRUUJYCKA-UHFFFAOYSA-NInChI: InChI=1S/C17H16O4/c18-16(14-8-3-1-4-9-14)20-12-7-13-21-17(19)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
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propan-2-yl 3，5-dihydroxybenzoateCas Number: 33046-40-1Formula: C10H12O4 Molecular Weight: 196.1999SMILES: CC(C)OC(=O)C1=CC(=CC(=C1)O)OInChIKey: SSHGYOXHBWVIPE-UHFFFAOYSA-NInChI: InChI=1S/C10H12O4/c1-6(2)14-10(13)7-3-8(11)5-9(12)4-7/h3-6,11-12H,1-2H3
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methyl 3-chloro-2-(chlorosulfonyl)benzoateCas Number: 99943-42-7Formula: C8H6Cl2O4S Molecular Weight: 269.1018SMILES: COC(=O)C1=C(C(=CC=C1)Cl)S(=O)(=O)ClInChIKey: ZJXLJSMVKPJWLX-UHFFFAOYSA-NInChI: InChI=1S/C8H6Cl2O4S/c1-14-8(11)5-3-2-4-6(9)7(5)15(10,12)13/h2-4H,1H3
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methyl 2-(bromomethyl)-3-((tert-butyldimethylsilyl)oxy)benzoateCas Number: 1323407-17-5 Compound CID: 58388876Formula: C15H23O3SiBr Molecular Weight: 359.33IUPAC Name: methyl 2-(bromomethyl)-3-[tert-butyl(dimethyl)silyl]oxybenzoateSMILES: CC(C)(C)[Si](C)(C)OC1=CC=CC(=C1CBr)C(=O)OCInChIKey: YOPIDFXZGOIPLC-UHFFFAOYSA-NInChI: InChI=1S/C15H23BrO3Si/c1-15(2,3)20(5,6)19-13-9-7-8-11(12(13)10-16)14(17)18-4/h7-9H,10H2,1-6H3
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decyl benzoateCas Number: 36685-97-9Formula: C17H26O2 Molecular Weight: 262.3871SMILES: CCCCCCCCCCOC(=O)C1=CC=CC=C1InChIKey: CUSUFTNOPPMGBK-UHFFFAOYSA-NInChI: InChI=1S/C17H26O2/c1-2-3-4-5-6-7-8-12-15-19-17(18)16-13-10-9-11-14-16/h9-11,13-14H,2-8,12,15H2,1H3
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Octyl Dimethyl PABACas Number: 58817-05-3 Compound CID: 42851Formula: C17H27NO2 Molecular Weight: 277.4IUPAC Name: octyl 4-(dimethylamino)benzoateSMILES: CCCCCCCCOC(=O)C1=CC=C(C=C1)N(C)CInChIKey: YAGMLECKUBJRNO-UHFFFAOYSA-NInChI: InChI=1S/C17H27NO2/c1-4-5-6-7-8-9-14-20-17(19)15-10-12-16(13-11-15)18(2)3/h10-13H,4-9,14H2,1-3H3
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Iodomethyl BenzoateCas Number: 13943-33-4Formula: C8H7IO2 Molecular Weight: 262.04SMILES: C1=CC=C(C=C1)C(=O)OCIInChIKey: KCQMUFYIGUHOMQ-UHFFFAOYSA-NInChI: InChI=1S/C8H7IO2/c9-6-11-8(10)7-4-2-1-3-5-7/h1-5H,6H2
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IscotrizinolCas Number: 154702-15-5 Compound CID: 9810816Formula: C44H59N7O5 Molecular Weight: 765.98IUPAC Name: 2-ethylhexyl 4-[[4-[4-(tert-butylcarbamoyl)anilino]-6-[4-(2-ethylhexoxycarbonyl)anilino]-1,3,5-triazin-2-yl]amino]benzoateSMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)C(=O)NC(C)(C)C)NC4=CC=C(C=C4)C(=O)OCC(CC)CCCCInChIKey: OSCJHTSDLYVCQC-UHFFFAOYSA-NInChI: show more
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Ethyl 2-(dimethylamino)benzoateIUPAC Name: ethyl 2-(dimethylamino)benzoateSMILES: CCOC(=O)C1=CC=CC=C1N(C)CInChIKey: ORBFAMHUKZLWSD-UHFFFAOYSA-NInChI: InChI=1S/C11H15NO2/c1-4-14-11(13)9-7-5-6-8-10(9)12(2)3/h5-8H,4H2,1-3H3
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Ethyl 2，5-dimethylbenzoateCas Number: 33499-43-3 Compound CID: 14325396IUPAC Name: ethyl 2,5-dimethylbenzoateSMILES: CCOC(=O)C1=C(C=CC(=C1)C)CInChIKey: DDZFMOLFXZLMPP-UHFFFAOYSA-NInChI: InChI=1S/C11H14O2/c1-4-13-11(12)10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3
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Dodecyl 2-hydroxybenzoateCas Number: 1160-35-6Formula: C19H30O3 Molecular Weight: 306.44SMILES: CCCCCCCCCCCCOC(=O)C1=CC=CC=C1OInChIKey: CJYBKFFVXWWBMY-UHFFFAOYSA-NInChI: InChI=1S/C19H30O3/c1-2-3-4-5-6-7-8-9-10-13-16-22-19(21)17-14-11-12-15-18(17)20/h11-12,14-15,20H,2-10,13,16H2,1H3
