1-(chloromethyl)-2,3,4,5,6-pentamethylbenzene

1-(chloromethyl)-2,3,4,5,6-pentamethylbenzene

CAS: 484-65-1

Formula: C12H17Cl

SMILES: CC1=C(C)C(C)=C(CCl)C(C)=C1C

IUPAC: 1-(chloromethyl)-2,3,4,5,6-pentamethylbenzene

InChI: InChI=1S/C12H17Cl/c1-7-8(2)10(4)12(6-13)11(5)9(7)3/h6H2,1-5H3

Composition: C (73.27%), H (8.71%), Cl (18.02%)

Molar Mass: 196.72

Atom Count: 30

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.1018782
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	CXUAEBDTJFKMBV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	61.13
Topological Polar Surface Area	0
Polarizability	22.81
Ring Count	1
Rotatable Bond Count	1

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