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3-bromoheptane

3-bromoheptane

CAS: 1974-05-6

Formula: C7H15Br

SMILES: CCCCC(Br)CC

IUPAC: 3-bromoheptane

InChI: InChI=1/C7H15Br/c1-3-5-6-7(8)4-2/h7H,3-6H2,1-2H3

Composition: C (46.94%), H (8.44%), Br (44.61%)

Molar Mass: 179.101

Atom Count: 23

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 178.035713
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey MLHXKYLLJRLHGH-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.71
Topological Polar Surface Area 0
Polarizability 16.27
Ring Count 0
Rotatable Bond Count 4

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