Home Halogens Ethanone, 2-chloro-1-(2-fluorophenyl)- (9CI)

Ethanone, 2-chloro-1-(2-fluorophenyl)- (9CI)

CAS No.:
53688-17-8
Catalog Number:
AG00DDKV
Molecular Formula:
C8H6ClFO
Molecular Weight:
172.5840
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Product Description
Catalog Number:
AG00DDKV
Chemical Name:
Ethanone, 2-chloro-1-(2-fluorophenyl)- (9CI)
CAS Number:
53688-17-8
Molecular Formula:
C8H6ClFO
Molecular Weight:
172.5840
MDL Number:
MFCD13194396
IUPAC Name:
2-chloro-1-(2-fluorophenyl)ethanone
InChI:
InChI=1S/C8H6ClFO/c9-5-8(11)6-3-1-2-4-7(6)10/h1-4H,5H2
InChI Key:
XIRBMNOJVJCHTR-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccccc1F
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.583g/mol
Monoisotopic Mass:
172.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties