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10166-09-3 | Benzeneacetyl chloride, 2-methyl-
CAS No: 10166-09-3 Catalog No: AG00054G MDL No:MFCD03424714
Product Description
Catalog Number:
AG00054G
Chemical Name:
Benzeneacetyl chloride, 2-methyl-
CAS Number:
10166-09-3
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
MDL Number:
MFCD03424714
IUPAC Name:
2-(2-methylphenyl)acetyl chloride
InChI:
InChI=1S/C9H9ClO/c1-7-4-2-3-5-8(7)6-9(10)11/h2-5H,6H2,1H3
InChI Key:
FKMIBYMTHOJWCY-UHFFFAOYSA-N
SMILES:
ClC(=O)Cc1ccccc1C
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:
2.9
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