Chem
J-GLOBAL ID：201807008051026323
Nikkaji number：J3.722.878H
(E)-4-Bromo-3-hexene-1-yne-1-ide
(E)-4-ブロモ-3-ヘキセン-1-イン-1-イド
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C5[C-]H6Br
Molecular formula furigana： C6-H6-BR
Molecular weight： 158.019
InChI：
InChI=1S/C6H6Br/c1-3-5-6(7)4-2/h5H,4H2,2H3/q-1/b6-5+
InChI key：
PABXZPNHHCDCRF-AATRIKPKSA-N
SMILES：
CC/C(=C\C#[C-])/Br
Systematic name (3)：
- (E)-4-ブロモ-3-ヘキセン-1-イン-1-イド
- (3E)-4-ブロモヘキサ-3-エン-1-イン-1-イド
- (3E)-4-bromohex-3-en-1-yn-1-ide
- (E)-4-Bromo-3-hexene-1-yne-1-ide
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