Home Other Building Blocks 2-benzoyl-4,5-difluorobenzoic acid

2-benzoyl-4,5-difluorobenzoic acid

CAS No.:
937635-08-0
Catalog Number:
AG01BGXR
Molecular Formula:
C14H8F2O3
Molecular Weight:
262.2083
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Product Description
Catalog Number:
AG01BGXR
Chemical Name:
2-benzoyl-4,5-difluorobenzoic acid
CAS Number:
937635-08-0
Molecular Formula:
C14H8F2O3
Molecular Weight:
262.2083
MDL Number:
MFCD08695088
IUPAC Name:
2-benzoyl-4,5-difluorobenzoic acid
InChI:
InChI=1S/C14H8F2O3/c15-11-6-9(10(14(18)19)7-12(11)16)13(17)8-4-2-1-3-5-8/h1-7H,(H,18,19)
InChI Key:
PVWSTKQYLMKFCC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(F)c(cc1C(=O)c1ccccc1)F
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.044g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.212g/mol
Monoisotopic Mass:
262.044g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties