chempirical

(2Z)-3-Methyl-2-penten-4-yn-1-ol

C6H8OCAS 6153-05-596.13 g/mol

Open in Covalent MOL file
OH
AlcoholAlkeneAlkyne

Properties

Molecular formula
C6H8O
Molar mass
96.13 g/mol
Exact mass
96.0575 Da
logP
0.56Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
6153-05-5
SMILES
C#C/C(C)=CCO
InChIKey
ZSJHASYJQIRSLE-XQRVVYSFSA-N
InChI
InChI=1S/C6H8O/c1-3-6(2)4-5-7/h1,4,7H,5H2,2H3/b6-4-

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 2-Penten-4-yn-1-ol, 3-methyl-, (2Z)-
  • 2-Penten-4-yn-1-ol, 3-methyl-, (Z)-
  • Z-3-Methyl-2-penten-4-yn-1-ol
  • cis-3-Methyl-2-penten-4-yn-1-ol
  • (Z)-3-Methylpent-2-en-4-yn-1-ol
  • cis-3-Methyl-2-pentene-4-yn-1-ol

Work with (2Z)-3-Methyl-2-penten-4-yn-1-ol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Prenol556-82-144 % similar Geraniol106-24-133 % similar Nerol106-25-233 % similar trans-Farnesol106-28-532 % similar Solanesol13190-97-132 % similar Geranylgeraniol24034-73-932 % similar Farnesol4602-84-032 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Methyl-2-penten-4-yn-1-ol105-29-3 Sorbaldehyde142-83-6 3-Methyl-2-cyclopenten-1-one2758-18-1 2-Ethylfuran3208-16-0 3-Methyl-1-penten-4-yn-3-ol3230-69-1 2,5-Dimethylfuran625-86-5 Cyclohexenone930-68-7

Elsewhere

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