Cas no 74174-31-5 (Haginin B)
Haginin B structure
Product Name:Haginin B
CAS No:74174-31-5
MF:C16H14O4
MW:270.279964923859
CID:2017059
PubChem ID:14077816
Update Time:2025-04-21
Haginin B Chemical and Physical Properties
Names and Identifiers
-
- Haginin B
- 7,4'-Dihydroxy-2'-methoxyisoflavene
- 3-(4-hydroxy-2-methoxyphenyl)-2H-chromen-7-ol
- 74174-31-5
- LMPK12080063
-
- Inchi: 1S/C16H14O4/c1-19-16-8-13(18)4-5-14(16)11-6-10-2-3-12(17)7-15(10)20-9-11/h2-8,17-18H,9H2,1H3
- InChI Key: RMENXIMFGIVCHR-UHFFFAOYSA-N
- SMILES: COC1C(C2COC3C(=CC=C(C=3)O)C=2)=CC=C(O)C=1
Computed Properties
- Exact Mass: 270.08920892Da
- Monoisotopic Mass: 270.08920892Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 367
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.619
- Topological Polar Surface Area: 58.9?2
Haginin B Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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