Cas no 181819-95-4 (7-Benzofuranmethanol, a-methyl-)
181819-95-4 structure
Product Name:7-Benzofuranmethanol, a-methyl-
CAS No:181819-95-4
MF:C10H10O2
MW:162.185203075409
CID:113712
PubChem ID:45122670
Update Time:2024-03-06
7-Benzofuranmethanol, a-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 7-Benzofuranmethanol, a-methyl-
- 7-Benzofuranmethanol, -alpha--methyl-
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- Inchi： 1S/C10H10O2/c1-7(11)9-4-2-3-8-5-6-12-10(8)9/h2-7,11H,1H3
- InChI Key： OYGYJQSFGYCBGS-UHFFFAOYSA-N
- SMILES： O1C=CC2=CC=CC(=C12)C(C)O
Computed Properties
- Exact Mass: 162.068079557g/mol
- Monoisotopic Mass: 162.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 158
- 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: 1.8
- Topological Polar Surface Area: 33.4?2
7-Benzofuranmethanol, a-methyl- Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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