Cas no 64230-78-0 (Benzenepropanol, b-amino-4-fluoro-)
64230-78-0 structure
Product Name:Benzenepropanol, b-amino-4-fluoro-
CAS No:64230-78-0
MF:C9H12FNO
MW:169.196085929871
CID:519238
PubChem ID:3048998
Update Time:2023-10-31
Benzenepropanol, b-amino-4-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanol, b-amino-4-fluoro-
- 2-amino-3-(4-fluorophenyl)propan-1-ol
- C9-H12-F-N-O
- AT10694
- 2-Amino-3-(p-fluorophenyl)-1-propanol
- SB44963
- AKOS006279579
- SB45160
- 35373-69-4
- b-Amino-4-fluorobenzenepropanol
- 1-Propanol, 2-amino-3-(p-fluorophenyl)-
- C9H12FNO
- DTXSID90982780
- EN300-123401
- SCHEMBL823637
- 64230-78-0
- BRN 2718796
- LS-121671
-
- Inchi： 1S/C9H12FNO/c10-8-3-1-7(2-4-8)5-9(11)6-12/h1-4,9,12H,5-6,11H2
- InChI Key： NHOCAYQCFORHNF-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)CC(CO)N
Computed Properties
- Exact Mass: 169.09036
- Monoisotopic Mass: 169.090292
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 124
- 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
- Topological Polar Surface Area: 46.2
- XLogP3: 0.7
Experimental Properties
- Density: 1.17
- Boiling Point: 307.6°C at 760 mmHg
- Flash Point: 139.8°C
- Refractive Index: 1.541
- PSA: 46.25
Benzenepropanol, b-amino-4-fluoro- Related Literature
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
64230-78-0 (Benzenepropanol, b-amino-4-fluoro-) Related Products
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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