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1-bromo-3,5-dimethyladamantane

1-bromo-3,5-dimethyladamantane

CAS: 941-37-7

Formula: C12H19Br

SMILES: CC12CC3CC(C)(C1)CC(Br)(C3)C2

IUPAC: 1-bromo-3,5-dimethyladamantane

InChI: InChI=1/C12H19Br/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8H2,1-2H3

Composition: C (59.27%), H (7.88%), Br (32.86%)

Molar Mass: 243.188

Atom Count: 32

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 242.067014
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey QUCXLVDIVQWYJR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.86
Topological Polar Surface Area 0
Polarizability 23.27
Ring Count 3
Rotatable Bond Count 0

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