2-chloro-4-methyl-1-(trifluoromethoxy)benzene

2-chloro-4-methyl-1-(trifluoromethoxy)benzene

CAS: 75462-60-1

Formula: C8H6ClF3O

SMILES: CC1=CC(Cl)=C(OC(F)(F)F)C=C1

IUPAC: 2-chloro-4-methyl-1-(trifluoromethoxy)benzene

InChI: InChI=1S/C8H6ClF3O/c1-5-2-3-7(6(9)4-5)13-8(10,11)12/h2-4H,1H3

Composition: C (45.63%), H (2.87%), Cl (16.83%), F (27.07%), O (7.60%)

Molar Mass: 210.58

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	210.005927
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ZLALBYGRUCKRIQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.97
Topological Polar Surface Area	9.23
Polarizability	16.01
Ring Count	1
Rotatable Bond Count	2

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