(3Z)-3,4-Dimethyl-3-hexene

C₈H₁₆CAS 19550-87-9112.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₁₆
Molar mass: 112.22 g/mol
Exact mass: 112.1252 Da
logP: 3.14Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2
Double bonds: ZE/Z, in SMILES order

Identifiers

CAS number

19550-87-9

SMILES

CC/C(C)=C(/C)CC

InChIKey

XTUXVDJHGIEBAA-FPLPWBNLSA-N

InChI

InChI=1S/C8H16/c1-5-7(3)8(4)6-2/h5-6H2,1-4H3/b8-7-

Weigh it out

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

Names and synonyms

5 names

3-Hexene, 3,4-dimethyl-, (3Z)-
3-Hexene, 3,4-dimethyl-, (Z)-
cis-3,4-Dimethyl-3-hexene
(Z)-3,4-Dimethyl-3-hexene
3,4-Dimethyl-cis-3-hexene

Work with (3Z)-3,4-Dimethyl-3-hexene

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

2-Methyl-1-butene563-46-239 % similar Butanone78-93-339 % similar 3-Ethyl-1,5-dihydro-4-methyl-2H-pyrrol-2-one766-36-936 % similar 3,4-Hexanedione4437-51-835 % similar 3-Methylenepentane760-21-435 % similar 3-Pentanone96-22-035 % similar 3-Methyl-2-pentene922-61-235 % similar Acetylpropionyl600-14-633 % similar

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

Same formula

2,4,4-Trimethyl-1-pentene107-39-1 2,4,4-Trimethyl-2-pentene107-40-4 Isooctene11071-47-9 1-Octene111-66-0 2-Octene111-67-1 trans-2-Octene13389-42-9 trans-4-Octene14850-23-8 trans-3-Octene14919-01-8

Elsewhere

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