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1000516-02-8 | 3-Pyridineacetic acid, 6-fluoro-
CAS No: 1000516-02-8 Catalog No: AG0000P4 MDL No:
Product Description
Catalog Number:
AG0000P4
Chemical Name:
3-Pyridineacetic acid, 6-fluoro-
CAS Number:
1000516-02-8
Molecular Formula:
C7H6FNO2
Molecular Weight:
155.1264
IUPAC Name:
2-(6-fluoropyridin-3-yl)acetic acid
InChI:
InChI=1S/C7H6FNO2/c8-6-2-1-5(4-9-6)3-7(10)11/h1-2,4H,3H2,(H,10,11)
InChI Key:
OOXCOBMQLZESRR-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc(nc1)F
Properties
Complexity:
151
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:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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