1,2-dimethyl-4-(3,3,3-trifluoropropyl)benzene

1,2-dimethyl-4-(3,3,3-trifluoropropyl)benzene

CAS: 1099597-42-8

Formula: C11H13F3

SMILES: CC1=C(C)C=C(CCC(F)(F)F)C=C1

IUPAC: 1,2-dimethyl-4-(3,3,3-trifluoropropyl)benzene

InChI: InChI=1S/C11H13F3/c1-8-3-4-10(7-9(8)2)5-6-11(12,13)14/h3-4,7H,5-6H2,1-2H3

Composition: C (65.34%), H (6.48%), F (28.18%)

Molar Mass: 202.22

Atom Count: 27

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	202.096934908
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	USDQFBDQIUKGKB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.17
Topological Polar Surface Area	0
Polarizability	18.5
Ring Count	1
Rotatable Bond Count	3

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