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2-chloro-1-fluoro-4-(prop-2-en-1-yl)benzene

2-chloro-1-fluoro-4-(prop-2-en-1-yl)benzene

CAS: 121626-73-1

Formula: C9H8ClF

SMILES: FC1=CC=C(CC=C)C=C1Cl

IUPAC: 2-chloro-1-fluoro-4-(prop-2-en-1-yl)benzene

InChI: InChI=1S/C9H8ClF/c1-2-3-7-4-5-9(11)8(10)6-7/h2,4-6H,1,3H2

Composition: C (63.36%), H (4.73%), Cl (20.78%), F (11.14%)

Molar Mass: 170.61

Atom Count: 19

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 170.0298561
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey LUVULFUQRHJDGP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.37
Topological Polar Surface Area 0
Polarizability 17.16
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 121626-73-1 $451.95-$1,500.75$451.95$661.25$1,500.75
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