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446-31-1 | 4-Amino-2-fluorobenzoic acid
CAS No: 446-31-1 Catalog No: AG003KOK MDL No:MFCD01569397
Product Description
Catalog Number:
AG003KOK
Chemical Name:
4-Amino-2-fluorobenzoic acid
CAS Number:
446-31-1
Molecular Formula:
C7H6FNO2
Molecular Weight:
155.1264
MDL Number:
MFCD01569397
IUPAC Name:
4-amino-2-fluorobenzoic acid
InChI:
InChI=1S/C7H6FNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)
InChI Key:
QHERSCUZBKDVOC-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)F)C(=O)O
NSC Number:
190362
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
155.128g/mol
Monoisotopic Mass:
155.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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