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(8-bromooctyl)benzene

(8-bromooctyl)benzene

CAS: 54646-75-2

Formula: C14H21Br

SMILES: BrCCCCCCCCC1=CC=CC=C1

IUPAC: (8-bromooctyl)benzene

InChI: InChI=1S/C14H21Br/c15-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12H,1-4,6,9-10,13H2

Composition: C (62.46%), H (7.86%), Br (29.68%)

Molar Mass: 269.226

Atom Count: 36

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 268.082664
Formal Charge 0
FSP3 0.57
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey XGBMCFCZEKCCDJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 71.27
Topological Polar Surface Area 0
Polarizability 27.54
Ring Count 1
Rotatable Bond Count 8

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