2-chloro-6-methylbenzoyl chloride

2-chloro-6-methylbenzoyl chloride

CAS: 89894-44-0

Formula: C8H6Cl2O

SMILES: CC1=C(C(Cl)=O)C(Cl)=CC=C1

IUPAC: 2-chloro-6-methylbenzoyl chloride

InChI: InChI=1S/C8H6Cl2O/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3

Composition: C (50.83%), H (3.20%), Cl (37.51%), O (8.46%)

Molar Mass: 189.04

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	187.9795702
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	NPRWNQSMJBAKCL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.02
Topological Polar Surface Area	17.07
Polarizability	17.77
Ring Count	1
Rotatable Bond Count	1

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