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1034980-59-0 | 4'-Chloro-2'-methylpropiophenone
CAS No: 1034980-59-0 Catalog No: AG01FEJ9 MDL No:
Product Description
Catalog Number:
AG01FEJ9
Chemical Name:
4'-Chloro-2'-methylpropiophenone
CAS Number:
1034980-59-0
Molecular Formula:
C10H11ClO
Molecular Weight:
182.6467
IUPAC Name:
1-(4-chloro-2-methylphenyl)propan-1-one
InChI:
InChI=1S/C10H11ClO/c1-3-10(12)9-5-4-8(11)6-7(9)2/h4-6H,3H2,1-2H3
InChI Key:
GZBQXWGNORCIRD-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(cc1C)Cl
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.05g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.647g/mol
Monoisotopic Mass:
182.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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