336-34-5 Purity
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Specification
The molecular formula of 4-Bromo-1-butene is C4H7Br.
The molecular weight of 4-Bromo-1-butene is 135.00 g/mol.
The IUPAC name of 4-Bromo-1-butene is 4-bromobut-1-ene.
The InChI of 4-Bromo-1-butene is InChI=1S/C4H7Br/c1-2-3-4-5/h2H,1,3-4H2.
The InChIKey of 4-Bromo-1-butene is DMAYBPBPEUFIHJ-UHFFFAOYSA-N.
The canonical SMILES of 4-Bromo-1-butene is C=CCCBr.
The CAS number of 4-Bromo-1-butene is 5162-44-7.
The XLogP3-AA value of 4-Bromo-1-butene is 2.1.
The hydrogen bond donor count of 4-Bromo-1-butene is 0.
Yes, 4-Bromo-1-butene is canonicalized.