Cas no 18753-50-9 (a-methyl-5-nitro-2-Furanmethanol)
18753-50-9 structure
Product Name:a-methyl-5-nitro-2-Furanmethanol
CAS No:18753-50-9
MF:C6H7NO4
MW:157.124081850052
CID:123170
PubChem ID:13435931
Update Time:2025-04-18
a-methyl-5-nitro-2-Furanmethanol Chemical and Physical Properties
Names and Identifiers
-
- a-methyl-5-nitro-2-Furanmethanol
- 2-Furanmethanol, alpha-methyl-5-nitro- (9CI)
- 2-Furanmethanol, a-methyl-5-nitro-
- SCHEMBL6741018
- 18753-50-9
- 1-(5-nitrofuran-2-yl)ethanol
-
- Inchi: 1S/C6H7NO4/c1-4(8)5-2-3-6(11-5)7(9)10/h2-4,8H,1H3
- InChI Key: HYGBOXNOCHXRPO-UHFFFAOYSA-N
- SMILES: O1C(=CC=C1C(C)O)[N+](=O)[O-]
Computed Properties
- Exact Mass: 157.03750770g/mol
- Monoisotopic Mass: 157.03750770g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 155
- 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: 0.9
- Topological Polar Surface Area: 79.2?2
a-methyl-5-nitro-2-Furanmethanol Related Literature
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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