Cas no 504433-57-2 (Benzenemethanol, 5-fluoro-2-(methylamino)- (9CI))
504433-57-2 structure
Product Name:Benzenemethanol, 5-fluoro-2-(methylamino)- (9CI)
CAS No:504433-57-2
MF:C8H10FNO
MW:155.169505596161
CID:1022914
PubChem ID:45090602
Update Time:2025-04-20
Benzenemethanol, 5-fluoro-2-(methylamino)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 5-fluoro-2-(methylamino)- (9CI)
- [5-fluoro-2-(methylamino)phenyl]methanol
- DTXSID60666661
- BENZENEMETHANOL, 5-FLUORO-2-(METHYLAMINO)-
- 504433-57-2
- DB-274147
-
- Inchi： 1S/C8H10FNO/c1-10-8-3-2-7(9)4-6(8)5-11/h2-4,10-11H,5H2,1H3
- InChI Key： QQYMRLCTMQTFOV-UHFFFAOYSA-N
- SMILES： FC1C=CC(=C(C=1)CO)NC
Computed Properties
- Exact Mass: 155.074642105g/mol
- Monoisotopic Mass: 155.074642105g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 121
- 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: 1.7
- Topological Polar Surface Area: 32.3?2
Benzenemethanol, 5-fluoro-2-(methylamino)- (9CI) Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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