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Carbonyl compounds
Description:
Organic compounds containing a carbonyl group, with the general structure RC(=O)R', where R=organyl, R'=H, N, O, organyl group or halide group.
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5-(3-FLUOROPHENYL)-5-OXOVALERIC ACIDCas Number: 845790-38-7 Compound CID: 2759127Formula: C11H11FO3 Molecular Weight: 210.21IUPAC Name: 5-(3-fluorophenyl)-5-oxopentanoic acidSMILES: C1=CC(=CC(=C1)F)C(=O)CCCC(=O)OInChIKey: VMDBDUOSNLRJAG-UHFFFAOYSA-NInChI: InChI=1S/C11H11FO3/c12-9-4-1-3-8(7-9)10(13)5-2-6-11(14)15/h1,3-4,7H,2,5-6H2,(H,14,15) -
5-Bromo-4-chloro-2-hydroxybenzaldehydeCas Number: 876492-31-8 Compound CID: 7172121Formula: C7H4BrClO2 Molecular Weight: 235.46IUPAC Name: 5-bromo-4-chloro-2-hydroxybenzaldehydeSMILES: C1=C(C(=CC(=C1Br)Cl)O)C=OInChIKey: JNRYILHFKYOXIK-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrClO2/c8-5-1-4(3-10)7(11)2-6(5)9/h1-3,11H
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4'-Ethoxy-2-methylpropiophenoneCas Number: 72846-63-0Formula: C12H16O2 Molecular Weight: 192.2542SMILES: CCOC1=CC=C(C=C1)C(=O)C(C)CInChIKey: POGPSKUWSGOZRN-UHFFFAOYSA-NInChI: InChI=1S/C12H16O2/c1-4-14-11-7-5-10(6-8-11)12(13)9(2)3/h5-9H,4H2,1-3H3
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4-(3-tosyl-2-(tosylmethyl)propanoyl)benzoic acidCas Number: 124243-00-1 Compound CID: 6420086Formula: C25H24O7S2 Molecular Weight: 500.6IUPAC Name: 4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzoic acidSMILES: CC1=CC=C(C=C1)S(=O)(=O)CC(CS(=O)(=O)C2=CC=C(C=C2)C)C(=O)C3=CC=C(C=C3)C(=O)OInChIKey: HGOBHXGITKMPPL-UHFFFAOYSA-NInChI: show more
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2，5-OctanedioneCas Number: 3214-41-3Formula: C8H14O2 Molecular Weight: 142.1956SMILES: CCCC(=O)CCC(=O)CInChIKey: SPDFSSLYVRCMDZ-UHFFFAOYSA-NInChI: InChI=1S/C8H14O2/c1-3-4-8(10)6-5-7(2)9/h3-6H2,1-2H3
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2，5-DiacetylfuranCas Number: 38071-72-6Formula: C8H8O3 Molecular Weight: 152.1473SMILES: CC(=O)C1=CC=C(O1)C(=O)CInChIKey: HJULPPMMCXMWJA-UHFFFAOYSA-NInChI: InChI=1S/C8H8O3/c1-5(9)7-3-4-8(11-7)6(2)10/h3-4H,1-2H3
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3'-Methoxy-4'-methylacetophenoneCas Number: 3556-81-8 Compound CID: 10130124Formula: C10H12O2 Molecular Weight: 164.2IUPAC Name: 1-(3-methoxy-4-methylphenyl)ethanoneSMILES: CC1=C(C=C(C=C1)C(=O)C)OCInChIKey: SZYKDYIBUSNYRS-UHFFFAOYSA-NInChI: InChI=1S/C10H12O2/c1-7-4-5-9(8(2)11)6-10(7)12-3/h4-6H,1-3H3
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2，5-Diaminocyclohexa-2，5-diene-1，4-dioneCas Number: 1521-06-8 Compound CID: 164848Formula: C6H6N2O2 Molecular Weight: 138.12IUPAC Name: 2,5-diaminocyclohexa-2,5-diene-1,4-dioneSMILES: C1=C(C(=O)C=C(C1=O)N)NInChIKey: VUVVIURXJWHENR-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2H,7-8H2
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2-Propanone，1-(1-methylethoxy)-Cas Number: 42781-12-4Formula: C6H12O2 Molecular Weight: 116.1583SMILES: CC(C)OCC(=O)CInChIKey: SICINPWJIHTHON-UHFFFAOYSA-NInChI: InChI=1S/C6H12O2/c1-5(2)8-4-6(3)7/h5H,4H2,1-3H3
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2-Chloro-1-(2，5-dihydroxyphenyl)ethanoneCas Number: 60912-82-5 Compound CID: 12298411IUPAC Name: 2-chloro-1-(2,5-dihydroxyphenyl)ethanoneSMILES: C1=CC(=C(C=C1O)C(=O)CCl)OInChIKey: LBQJAEBXOIEKLM-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClO3/c9-4-8(12)6-3-5(10)1-2-7(6)11/h1-3,10-11H,4H2
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2-Chloro-N-(3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl)acetamideCas Number: 50508-89-9 Compound CID: 12562369Formula: C15H13Cl2NO2S Molecular Weight: 342.2IUPAC Name: 2-chloro-N-[3-(2-chlorobenzoyl)-5-ethylthiophen-2-yl]acetamideSMILES: CCC1=CC(=C(S1)NC(=O)CCl)C(=O)C2=CC=CC=C2ClInChIKey: RWDKLJQZPVCCTO-UHFFFAOYSA-NInChI: InChI=1S/C15H13Cl2NO2S/c1-2-9-7-11(15(21-9)18-13(19)8-16)14(20)10-5-3-4-6-12(10)17/h3-7H,2,8H2,1H3,(H,18,19)
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2-Bromo-1-(4-chloro-2-methoxyphenyl)ethanoneCas Number: 60208-06-2 Compound CID: 79015136Formula: C9H8BrClO2 Molecular Weight: 263.51IUPAC Name: 2-bromo-1-(4-chloro-2-methoxyphenyl)ethanoneSMILES: COC1=C(C=CC(=C1)Cl)C(=O)CBrInChIKey: FDGIQMRTLABTHW-UHFFFAOYSA-NInChI: InChI=1S/C9H8BrClO2/c1-13-9-4-6(11)2-3-7(9)8(12)5-10/h2-4H,5H2,1H3
