1-chloro-4-(3,3,3-trifluoroprop-1-en-2-yl)benzene

1-chloro-4-(3,3,3-trifluoroprop-1-en-2-yl)benzene

CAS: 69843-10-3

Formula: C9H6ClF3

SMILES: FC(F)(F)C(=C)C1=CC=C(Cl)C=C1

IUPAC: 1-chloro-4-(3,3,3-trifluoroprop-1-en-2-yl)benzene

InChI: InChI=1S/C9H6ClF3/c1-6(9(11,12)13)7-2-4-8(10)5-3-7/h2-5H,1H2

Composition: C (52.32%), H (2.93%), Cl (17.16%), F (27.59%)

Molar Mass: 206.59

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	206.0110124
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	VEIIKBNWQPDEAL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.76
Topological Polar Surface Area	0
Polarizability	16.81
Ring Count	1
Rotatable Bond Count	2

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