Home Aminos Benzoic acid, 2-amino-5-fluoro-3-nitro- (9CI)

Benzoic acid, 2-amino-5-fluoro-3-nitro- (9CI)

CAS No.:
177960-62-2
Catalog Number:
AG00AUZQ
Molecular Formula:
C7H5FN2O4
Molecular Weight:
200.1240
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00AUZQ
Chemical Name:
Benzoic acid, 2-amino-5-fluoro-3-nitro- (9CI)
CAS Number:
177960-62-2
Molecular Formula:
C7H5FN2O4
Molecular Weight:
200.1240
MDL Number:
MFCD10690693
IUPAC Name:
2-amino-5-fluoro-3-nitrobenzoic acid
InChI:
InChI=1S/C7H5FN2O4/c8-3-1-4(7(11)12)6(9)5(2-3)10(13)14/h1-2H,9H2,(H,11,12)
InChI Key:
PJWWMVQRAZJKGT-UHFFFAOYSA-N
SMILES:
Fc1cc([N+](=O)[O-])c(c(c1)C(=O)O)N
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.023g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.125g/mol
Monoisotopic Mass:
200.023g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties