200,000+ products from a single source!

sales@angenechem.com

Home > Amines > 1094239-41-4

1094239-41-4

1094239-41-4 | [1-(4-Fluoro-phenyl)-ethylamino]-acetic acid

CAS No: 1094239-41-4 Catalog No: AG01FAJI MDL No:

Product Description

Catalog Number:
AG01FAJI
Chemical Name:
[1-(4-Fluoro-phenyl)-ethylamino]-acetic acid
CAS Number:
1094239-41-4
Molecular Formula:
C10H12FNO2
Molecular Weight:
197.2062
IUPAC Name:
2-[1-(4-fluorophenyl)ethylamino]acetic acid
InChI:
InChI=1S/C10H12FNO2/c1-7(12-6-10(13)14)8-2-4-9(11)5-3-8/h2-5,7,12H,6H2,1H3,(H,13,14)
InChI Key:
BGOMWVQOWVNJFD-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)F)NCC(=O)O

Properties

Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.209g/mol
Monoisotopic Mass:
197.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  

© 2019 Angene International Limited. All rights Reserved.