1,2,4-Trivinylcyclohexane

C₁₂H₁₈CAS 2855-27-8162.28 g/mol

Open in Covalent MOL file

Alkene

Properties

Molecular formula: C₁₂H₁₈
Molar mass: 162.28 g/mol
Exact mass: 162.1409 Da
Boiling point: 90 °C (at 11 Torr)
logP: 3.58Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H317 May cause an allergic skin reaction73.2% of notifiers
H319 Causes serious eye irritation26.1% of notifiers
H335 May cause respiratory irritation25.5% of notifiers
H411 Toxic to aquatic life with long lasting effects68.6% of notifiers

Aggregated from 153 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

2855-27-8

SMILES

C=CC1CCC(C=C)C(C=C)C1

InChIKey

KTRQRAQRHBLCSQ-UHFFFAOYSA-N

InChI

InChI=1S/C12H18/c1-4-10-7-8-11(5-2)12(6-3)9-10/h4-6,10-12H,1-3,7-9H2

Weigh it out

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

Names and synonyms

5 names

Cyclohexane, 1,2,4-triethenyl-
Cyclohexane, 1,2,4-trivinyl-
1,2,4-Triethenylcyclohexane
NSC 78467
1,2,4-Tris(ethenyl)cyclohexane

Work with 1,2,4-Trivinylcyclohexane

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

Vinyl norbornene3048-64-454 % similar 3-Ethenyl-7-oxabicyclo[4.1.0]heptane106-86-548 % similar Vinylcyclohexane695-12-542 % similar 4-Vinylcyclohexene100-40-336 % similar (Trans,trans)-4-Ethenyl-4′-propyl-1,1′-bicyclohexyl116020-44-134 % similar (Trans,trans)-4-Ethenyl-4'-propyl-1,1'-bicyclohexyl477557-80-534 % similar (Trans,trans)-4-Butyl-4′-ethenyl-1,1′-bicyclohexyl153429-47-132 % similar (Trans,trans)-4-Ethenyl-4′-pentyl-1,1′-bicyclohexyl129738-34-731 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,4-Diisopropylbenzene100-18-5 1,3,5-Triethylbenzene102-25-0 Hexylbenzene1077-16-3 1-tert-Butyl-3-ethylbenzene14411-56-4 Bis(1-methylethyl)benzene25321-09-9 1,5,9-Cyclododecatriene4904-61-4 3,9-Dodecadiyne61827-89-2 Trans,trans,trans-1,5,9-Cyclododecatriene676-22-2

Elsewhere

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