Home Halogens Ethanone, 2-chloro-1-(2-chloro-4-fluoro-5-methylphenyl)- (9CI)

Ethanone, 2-chloro-1-(2-chloro-4-fluoro-5-methylphenyl)- (9CI)

CAS No.:
154258-17-0
Catalog Number:
AG00AZ88
Molecular Formula:
C9H7Cl2FO
Molecular Weight:
221.0557
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Product Description
Catalog Number:
AG00AZ88
Chemical Name:
Ethanone, 2-chloro-1-(2-chloro-4-fluoro-5-methylphenyl)- (9CI)
CAS Number:
154258-17-0
Molecular Formula:
C9H7Cl2FO
Molecular Weight:
221.0557
MDL Number:
MFCD22375220
IUPAC Name:
2-chloro-1-(2-chloro-4-fluoro-5-methylphenyl)ethanone
InChI:
InChI=1S/C9H7Cl2FO/c1-5-2-6(9(13)4-10)7(11)3-8(5)12/h2-3H,4H2,1H3
InChI Key:
QEOBKVTZODEYCZ-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1cc(C)c(cc1Cl)F
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.986g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.052g/mol
Monoisotopic Mass:
219.986g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties