Cas no 149705-60-2 (4-hydroxy-3-Benzofuranmethanol)
149705-60-2 structure
Product Name:4-hydroxy-3-Benzofuranmethanol
CAS No:149705-60-2
MF:C9H8O3
MW:164.158022880554
CID:100114
PubChem ID:45122681
Update Time:2025-04-18
4-hydroxy-3-Benzofuranmethanol Chemical and Physical Properties
Names and Identifiers
-
- 4-hydroxy-3-Benzofuranmethanol
- 3-(hydroxymethyl)-1-benzofuran-4-ol
- 3-Benzofuranmethanol,4-hydroxy-
- 3-Benzofuranmethanol, 4-hydroxy-
- 3-(hydroxymethyl)benzofuran-4-ol
- 149705-60-2
-
- Inchi： 1S/C9H8O3/c10-4-6-5-12-8-3-1-2-7(11)9(6)8/h1-3,5,10-11H,4H2
- InChI Key： DXAAVGXQYPBHCL-UHFFFAOYSA-N
- SMILES： O1C=C(CO)C2C(=CC=CC1=2)O
Computed Properties
- Exact Mass: 164.04734
- Monoisotopic Mass: 164.047344113g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 160
- 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: 1.1
- Topological Polar Surface Area: 53.6?2
Experimental Properties
- PSA: 53.6
4-hydroxy-3-Benzofuranmethanol Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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