Home Other Building Blocks 2-fluoro-3-methylisonicotinic acid

2-fluoro-3-methylisonicotinic acid

CAS No.:
885589-17-3
Catalog Number:
AG01DEGN
Molecular Formula:
C7H6FNO2
Molecular Weight:
155.1264
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Product Description
Catalog Number:
AG01DEGN
Chemical Name:
2-fluoro-3-methylisonicotinic acid
CAS Number:
885589-17-3
Molecular Formula:
C7H6FNO2
Molecular Weight:
155.1264
MDL Number:
MFCD16611272
IUPAC Name:
2-fluoro-3-methylpyridine-4-carboxylic acid
InChI:
InChI=1S/C7H6FNO2/c1-4-5(7(10)11)2-3-9-6(4)8/h2-3H,1H3,(H,10,11)
InChI Key:
HGRPMRJSAWEGCE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnc(c1C)F
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:
1  
Isotope Atom Count:
0
Molecular Weight:
155.128g/mol
Monoisotopic Mass:
155.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties