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1-bromo-2-(prop-2-en-1-yl)benzene

1-bromo-2-(prop-2-en-1-yl)benzene

CAS: 42918-20-7

Formula: C9H9Br

SMILES: BrC1=CC=CC=C1CC=C

IUPAC: 1-bromo-2-(prop-2-en-1-yl)benzene

InChI: InChI=1S/C9H9Br/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7H,1,5H2

Composition: C (54.85%), H (4.60%), Br (40.54%)

Molar Mass: 197.075

Atom Count: 19

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 195.988763
Formal Charge 0
FSP3 0.11
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey NTYPQDZCDDLKLV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.97
Topological Polar Surface Area 0
Polarizability 18.3
Ring Count 1
Rotatable Bond Count 2

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