(3,3,3-trifluoropropyl)benzene

(3,3,3-trifluoropropyl)benzene

CAS: 1579-80-2

Formula: C9H9F3

SMILES: FC(F)(F)CCC1=CC=CC=C1

IUPAC: (3,3,3-trifluoropropyl)benzene

InChI: InChI=1S/C9H9F3/c10-9(11,12)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2

Composition: C (62.07%), H (5.21%), F (32.72%)

Molar Mass: 174.166

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	174.065634779
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	NLMURJDGDBEMAB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.08
Topological Polar Surface Area	0
Polarizability	15.02
Ring Count	1
Rotatable Bond Count	3

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