Home Halogens 2-(4-chloro-2-fluorophenyl)benzoic acid

2-(4-chloro-2-fluorophenyl)benzoic acid

CAS No.:
1518644-27-3
Catalog Number:
AG01EKG8
Molecular Formula:
C13H8ClFO2
Molecular Weight:
250.6528
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Product Description
Catalog Number:
AG01EKG8
Chemical Name:
2-(4-chloro-2-fluorophenyl)benzoic acid
CAS Number:
1518644-27-3
Molecular Formula:
C13H8ClFO2
Molecular Weight:
250.6528
MDL Number:
MFCD23396869
IUPAC Name:
2-(4-chloro-2-fluorophenyl)benzoic acid
InChI:
InChI=1S/C13H8ClFO2/c14-8-5-6-10(12(15)7-8)9-3-1-2-4-11(9)13(16)17/h1-7H,(H,16,17)
InChI Key:
ANTDOZHUPIWPON-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)F)c1ccccc1C(=O)O
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.02g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.653g/mol
Monoisotopic Mass:
250.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties