(3Z)-1-(1-Ethoxyethoxy)-3-hexene

C₁₀H₂₀O₂CAS 28069-74-1172.27 g/mol

Open in Covalent MOL file

Acetal Alkene Ether

Properties

Molecular formula: C₁₀H₂₀O₂
Molar mass: 172.27 g/mol
Exact mass: 172.1463 Da
logP: 2.74Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 7

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

28069-74-1

SMILES

CC/C=CCCOC(C)OCC

InChIKey

PAEBAEDUARAOSG-SREVYHEPNA-N

InChI

InChI=1/C10H20O2/c1-4-6-7-8-9-12-10(3)11-5-2/h6-7,10H,4-5,8-9H2,1-3H3/b7-6-

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

Names and synonyms

5 names

3-Hexene, 1-(1-ethoxyethoxy)-, (3Z)-
Acetaldehyde, ethyl 3-hexenyl acetal, (Z)-
3-Hexene, 1-(1-ethoxyethoxy)-, (Z)-
Ethane, 1-ethoxy-1-(3-hexenyloxy)-, (Z)-
Leaf acetal

Work with (3Z)-1-(1-Ethoxyethoxy)-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

1,1-Diethoxyethane105-57-754 % similar [2-(1-Ethoxyethoxy)ethyl]benzene2556-10-746 % similar cis-3-Hexenyl isobutyrate41519-23-742 % similar cis-3-Hexenyl formate33467-73-141 % similar 2-Methyl-1,3-dioxolane497-26-741 % similar cis-3-Hexenyl isovalerate35154-45-140 % similar cis-3-Hexenyl 2-methylbutanoate53398-85-939 % similar (Z)-3-Hexenyl lactate61931-81-539 % similar

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

Same formula

2-Ethylhexyl acetate103-09-3 Isobutyl hexanoate105-79-3 Ethyl octanoate106-32-1 Hydroxycitronellal107-75-5 Octyl acetate112-14-1 4-Ethyloctanoic acid16493-80-4 1,1-Diethoxycyclohexane1670-47-9 Methyl nonanoate1731-84-6

Elsewhere

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