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Phenols
Description:
Compounds containing a phenol moiety, which is a benzene bearing a hydroxyl group.
Ancestors:
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2-Bromo-N-(3，4-dihydroxyphenethyl)propanamideCas Number: 862673-06-1Formula: C11H14BrNO3 Molecular Weight: 288.14SMILES: CC(C(=O)NCCC1=CC(=C(C=C1)O)O)BrInChIKey: LGZVAJNPGRBFOC-UHFFFAOYSA-NInChI: InChI=1S/C11H14BrNO3/c1-7(12)11(16)13-5-4-8-2-3-9(14)10(15)6-8/h2-3,6-7,14-15H,4-5H2,1H3,(H,13,16) -
2-Iodo-4-methoxyphenolCas Number: 312534-71-7 Compound CID: 11357127Formula: C7H7IO2 Molecular Weight: 250.03IUPAC Name: 2-iodo-4-methoxyphenolSMILES: COC1=CC(=C(C=C1)O)IInChIKey: QCYNENHPQYYEBD-UHFFFAOYSA-NInChI: InChI=1S/C7H7IO2/c1-10-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3
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2-Bromo-3-hydroxy-4-methoxybenzaldehydeCas Number: 2973-58-2 Compound CID: 224011Formula: BrC6H2(OH)(OCH3)CHO Molecular Weight: 231.04IUPAC Name: 2-bromo-3-hydroxy-4-methoxybenzaldehydeSMILES: COC1=C(C(=C(C=C1)C=O)Br)OInChIKey: QPDFBPIHEDAUKK-UHFFFAOYSA-NInChI: InChI=1S/C8H7BrO3/c1-12-6-3-2-5(4-10)7(9)8(6)11/h2-4,11H,1H3
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2-Methoxyphenol-d3Cas Number: 74495-69-5 Compound CID: 12213392Formula: C7H5D3O2 Molecular Weight: 127.16IUPAC Name: 2-(trideuteriomethoxy)phenolSMILES: COC1=CC=CC=C1OInChIKey: LHGVFZTZFXWLCP-FIBGUPNXSA-NInChI: InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3/i1D3
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2-(2-Bromo-4-hydroxyphenyl)acetic acidCas Number: 88491-44-5 Compound CID: 24721648Formula: C8H7BrO3 Molecular Weight: 231.04IUPAC Name: 2-(2-bromo-4-hydroxyphenyl)acetic acidSMILES: C1=CC(=C(C=C1O)Br)CC(=O)OInChIKey: DYIKUAMKHXANMT-UHFFFAOYSA-NInChI: InChI=1S/C8H7BrO3/c9-7-4-6(10)2-1-5(7)3-8(11)12/h1-2,4,10H,3H2,(H,11,12)
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(R)-2-(1-Aminoethyl)-4-fluorophenoCas Number: 1228570-33-9Formula:IUPAC Name: 2-(1-aminoethyl)-4-fluorophenolSMILES: CC(C1=C(C=CC(=C1)F)O)NInChIKey: SSNRPTHWRFURQQ-UHFFFAOYSA-NInChI: InChI=1S/C8H10FNO/c1-5(10)7-4-6(9)2-3-8(7)11/h2-5,11H,10H2,1H3
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(R)-3-(1-HYDROXYPROPYL)PHENOLCas Number: 625852-10-0Formula: C8H10O2 Molecular Weight: 138.16SMILES: CC(C1=CC(=CC=C1)O)OInChIKey: COJRWHSKVYUZHQ-ZCFIWIBFSA-NInChI: InChI=1S/C8H10O2/c1-6(9)7-3-2-4-8(10)5-7/h2-6,9-10H,1H3/t6-/m1/s1
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rac 1-Chloro-3-[4-(2-methoxyethyl)phenoxy]-2-propanolCas Number: 56718-76-4 Compound CID: 2793898Formula: C12H17ClO3 Molecular Weight: 244.71IUPAC Name: 1-chloro-3-[4-(2-methoxyethyl)phenoxy]propan-2-olSMILES: COCCC1=CC=C(C=C1)OCC(CCl)OInChIKey: MAVSBQOSROXJQJ-UHFFFAOYSA-NInChI: InChI=1S/C12H17ClO3/c1-15-7-6-10-2-4-12(5-3-10)16-9-11(14)8-13/h2-5,11,14H,6-9H2,1H3
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Nonylphenol(mixture of isomers)Cas Number: 25154-52-3Formula: C15H24O Molecular Weight: 220.35IUPAC Name: 2-nonylphenolSMILES: CCCCCCCCCC1=CC=CC=C1OInChIKey: SNQQPOLDUKLAAF-UHFFFAOYSA-NInChI: InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3Synonyms: 2-Nonylphenol
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Nonylphenol(mixture of isomers)Cas Number: 25154-52-3Formula: C15H24O Molecular Weight: 220.35IUPAC Name: 2-nonylphenolSMILES: CCCCCCCCCC1=CC=CC=C1OInChIKey: SNQQPOLDUKLAAF-UHFFFAOYSA-NInChI: InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3
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NifursolCas Number: 16915-70-1 Compound CID: 9570327Formula: C12H7N5O9 Molecular Weight: 365.21IUPAC Name: 2-hydroxy-3,5-dinitro-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]benzamideSMILES: C1=C(OC(=C1)[N+](=O)[O-])C=NNC(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])OInChIKey: XXUXXCZCUGIGPP-WLRTZDKTSA-NInChI: InChI=1S/C12H7N5O9/c18-11-8(3-6(15(20)21)4-9(11)16(22)23)12(19)14-13-5-7-1-2-10(26-7)17(24)25/h1-5,18H,(H,14,19)/b13-5+
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Benzeneacetic acid， 3-hydroxy-4-methoxy-， methyl esterCas Number: 15964-81-5 Compound CID: 10465267Formula: C10H12O4 Molecular Weight: 196.21IUPAC Name: methyl 2-(3-hydroxy-4-methoxyphenyl)acetateSMILES: COC1=C(C=C(C=C1)CC(=O)OC)OInChIKey: NLPRPUVYIZIMMA-UHFFFAOYSA-NInChI: InChI=1S/C10H12O4/c1-13-9-4-3-7(5-8(9)11)6-10(12)14-2/h3-5,11H,6H2,1-2H3
