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Home > Fluorides > 1365271-83-5

1365271-83-5

1365271-83-5 | Benzoic acid, 3-fluoro-5-(3-fluoro-2-pyridinyl)-

CAS No: 1365271-83-5 Catalog No: AG0011YQ MDL No:MFCD21609725

Product Description

Catalog Number:
AG0011YQ
Chemical Name:
Benzoic acid, 3-fluoro-5-(3-fluoro-2-pyridinyl)-
CAS Number:
1365271-83-5
Molecular Formula:
C12H7F2NO2
Molecular Weight:
235.1863
MDL Number:
MFCD21609725
IUPAC Name:
3-fluoro-5-(3-fluoropyridin-2-yl)benzoic acid
InChI:
InChI=1S/C12H7F2NO2/c13-9-5-7(4-8(6-9)12(16)17)11-10(14)2-1-3-15-11/h1-6H,(H,16,17)
InChI Key:
XBHWTAHYZCUNLY-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)c1ncccc1F)C(=O)O

Properties

Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.044g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.19g/mol
Monoisotopic Mass:
235.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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