Cas no 10499-17-9 (2H-1-Benzopyran-7-ol,3,4-dihydro-3-(4-methoxyphenyl)-)
10499-17-9 structure
Product Name:2H-1-Benzopyran-7-ol,3,4-dihydro-3-(4-methoxyphenyl)-
CAS No:10499-17-9
MF:C16H16O3
MW:256.296444892883
CID:170138
PubChem ID:23652247
Update Time:2024-11-07
2H-1-Benzopyran-7-ol,3,4-dihydro-3-(4-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran-7-ol,3,4-dihydro-3-(4-methoxyphenyl)-
- LogP
- 3-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
- CHEMBL453016
- 4'-O-Methyl equol
- 7-Isoflavanol, 4'-methoxy-
- 4'-Methoxy-7-isoflavanol
- 7-Hydroxy-4alpha-methoxyisoflavone
- Equol 4'-methyl ether
- SCHEMBL12914761
- (+-)-isomer of equol
- 3-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-ol
- 10499-17-9
- DTXSID90909290
- 7-Hydroxy-4'-methoxyisoflavan
- BDBM50491179
- 2H-1-Benzopyran-7-ol, 3,4-dihydro-3-(4-methoxyphenyl)-
-
- Inchi： 1S/C16H16O3/c1-18-15-6-3-11(4-7-15)13-8-12-2-5-14(17)9-16(12)19-10-13/h2-7,9,13,17H,8,10H2,1H3
- InChI Key： FPRFNXQLWQOWED-UHFFFAOYSA-N
- SMILES： O1C2C=C(C=CC=2CC(C2C=CC(=CC=2)OC)C1)O
Computed Properties
- Exact Mass: 256.10998
- Monoisotopic Mass: 256.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 286
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.69
2H-1-Benzopyran-7-ol,3,4-dihydro-3-(4-methoxyphenyl)- Related Literature
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
10499-17-9 (2H-1-Benzopyran-7-ol,3,4-dihydro-3-(4-methoxyphenyl)-) Related Products
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