200,000+ products from a single source!

sales@angenechem.com

Home > Amines > 1214335-16-6

1214335-16-6

1214335-16-6 | Benzoic acid, 3-amino-2-fluoro-, ethyl ester

CAS No: 1214335-16-6 Catalog No: AG0014U5 MDL No:

Product Description

Catalog Number:
AG0014U5
Chemical Name:
Benzoic acid, 3-amino-2-fluoro-, ethyl ester
CAS Number:
1214335-16-6
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
IUPAC Name:
ethyl 3-amino-2-fluorobenzoate
InChI:
InChI=1S/C9H10FNO2/c1-2-13-9(12)6-4-3-5-7(11)8(6)10/h3-5H,2,11H2,1H3
InChI Key:
VYXXXMWMWZGHDK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1F)N

Properties

Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.07g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.182g/mol
Monoisotopic Mass:
183.07g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

© 2019 Angene International Limited. All rights Reserved.