Home Aminos 3-amino-2,4-difluorobenzoic acid

3-amino-2,4-difluorobenzoic acid

CAS No.:
1512022-61-5
Catalog Number:
AG01C7BG
Molecular Formula:
C7H5F2NO2
Molecular Weight:
173.1169
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Product Description
Catalog Number:
AG01C7BG
Chemical Name:
3-amino-2,4-difluorobenzoic acid
CAS Number:
1512022-61-5
Molecular Formula:
C7H5F2NO2
Molecular Weight:
173.1169
MDL Number:
MFCD28722252
IUPAC Name:
3-amino-2,4-difluorobenzoic acid
InChI:
InChI=1S/C7H5F2NO2/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2H,10H2,(H,11,12)
InChI Key:
UHKSPMLBRAFUIH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1F)N)F
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
173.119g/mol
Monoisotopic Mass:
173.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties