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6305-95-9 | 1-(2-Chlorophenyl)propan-2-one
CAS No: 6305-95-9 Catalog No: AG003CTV MDL No:MFCD00045175
Product Description
Catalog Number:
AG003CTV
Chemical Name:
1-(2-Chlorophenyl)propan-2-one
CAS Number:
6305-95-9
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
MDL Number:
MFCD00045175
IUPAC Name:
1-(2-chlorophenyl)propan-2-one
InChI:
InChI=1S/C9H9ClO/c1-7(11)6-8-4-2-3-5-9(8)10/h2-5H,6H2,1H3
InChI Key:
LWGNDIMNCPMZOF-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1ccccc1Cl
NSC Number:
22986
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.034g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.62g/mol
Monoisotopic Mass:
168.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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