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1260650-69-8

1260650-69-8 | Benzoic acid, 4-(3-fluoro-2-pyridinyl)-

CAS No: 1260650-69-8 Catalog No: AG000QYA MDL No:MFCD11042907

Product Description

Catalog Number:
AG000QYA
Chemical Name:
Benzoic acid, 4-(3-fluoro-2-pyridinyl)-
CAS Number:
1260650-69-8
Molecular Formula:
C12H8FNO2
Molecular Weight:
217.1958
MDL Number:
MFCD11042907
IUPAC Name:
4-(3-fluoropyridin-2-yl)benzoic acid
InChI:
InChI=1S/C12H8FNO2/c13-10-2-1-7-14-11(10)8-3-5-9(6-4-8)12(15)16/h1-7H,(H,15,16)
InChI Key:
PJLFLAVUDJSGDA-UHFFFAOYSA-N
SMILES:
Fc1cccnc1c1ccc(cc1)C(=O)O

Properties

Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.054g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.199g/mol
Monoisotopic Mass:
217.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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