Home Other Building Blocks 2-aMino-4-fluoro-5-hydroxybenzoic acid

2-aMino-4-fluoro-5-hydroxybenzoic acid

CAS No.:
1250931-52-2
Catalog Number:
AG00A0QY
Molecular Formula:
C7H6FNO3
Molecular Weight:
171.1258
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Product Description
Catalog Number:
AG00A0QY
Chemical Name:
2-aMino-4-fluoro-5-hydroxybenzoic acid
CAS Number:
1250931-52-2
Molecular Formula:
C7H6FNO3
Molecular Weight:
171.1258
MDL Number:
MFCD16159181
IUPAC Name:
2-amino-4-fluoro-5-hydroxybenzoic acid
InChI:
InChI=1S/C7H6FNO3/c8-4-2-5(9)3(7(11)12)1-6(4)10/h1-2,10H,9H2,(H,11,12)
InChI Key:
IKMAMBNXGFEOHS-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(O)c(cc1N)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:
171.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
171.127g/mol
Monoisotopic Mass:
171.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties