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2-chloro-N-(5-chloro-2-methylphenyl)acetamide

2-chloro-N-(5-chloro-2-methylphenyl)acetamide

CAS: 85817-60-3

Formula: C9H9Cl2NO

SMILES: CC1=C(NC(=O)CCl)C=C(Cl)C=C1

IUPAC: 2-chloro-N-(5-chloro-2-methylphenyl)acetamide

InChI: InChI=1S/C9H9Cl2NO/c1-6-2-3-7(11)4-8(6)12-9(13)5-10/h2-4H,5H2,1H3,(H,12,13)

Composition: C (49.57%), H (4.16%), Cl (32.51%), N (6.42%), O (7.34%)

Molar Mass: 218.08

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 217.0061193
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey WAGYENKYIROKOE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.52
Topological Polar Surface Area 29.1
Polarizability 20.71
Ring Count 1
Rotatable Bond Count 2

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