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4-bromobut-1-yne

4-bromobut-1-yne

CAS: 38771-21-0

Formula: C4H5Br

SMILES: BrCCC#C

IUPAC: 4-bromobut-1-yne

InChI: InChI=1S/C4H5Br/c1-2-3-4-5/h1H,3-4H2

Composition: C (36.13%), H (3.79%), Br (60.08%)

Molar Mass: 132.988

Atom Count: 10

Heavy Atom Count: 5

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 131.957463
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey XLYOGWXIKVUXCL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 26.63
Topological Polar Surface Area 0
Polarizability 9.8
Ring Count 0
Rotatable Bond Count 1

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