1,2,4-Trivinylcyclohexane, mixture of isomers

Product Information

Molecular Formula:
C12H18
Molecular Weight:
162.27
Description
1,2,4-Trivinylcyclohexane, mixture of isomers (CAS# 2855-27-8) is a useful research chemical.
Synonyms
1,2,4-tris(ethenyl)cyclohexane
IUPAC Name
1,2,4-tris(ethenyl)cyclohexane
Canonical SMILES
C=CC1CCC(C(C1)C=C)C=C
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
InChI Key
KTRQRAQRHBLCSQ-UHFFFAOYSA-N
Boiling Point
88 °C / 20 mmHg
Flash Point
69 °C
Purity
> 97.0 % (GC)
Density
0.96 g/cm3
Appearance
Colorless to light yellow clear liquid
Application
Used as an intermediate.
LogP
3.57690

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

XLogP3
4.3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
3
Exact Mass
162.140850574 g/mol
Monoisotopic Mass
162.140850574 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
179
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
3
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

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TW-I745233-B Resin composition and its products 2021-02-03
CN-112876858-A Organic polysilicone-fluorine composition and preparation method thereof 2021-01-15
CN-112322048-A Organic silicon gel composition and preparation method and application thereof 2020-11-03
CN-114181511-A Resin composition and product thereof 2020-09-15
CN-114181530-A Bioelectrode composition, bioelectrode, method for producing bioelectrode, and silicon material particle 2020-09-15
DE-102020124036-A1 Stabilizer system containing sulfide for thiol-ene and thiol-yne compositions 2020-09-15
EP-3968343-A2 Bio-electrode composition, bio-electrode, method for manufacturing bio-electrode, and silicon material particle 2020-09-15
US-2022079461-A1 Bio-electrode composition, bio-electrode, method for manufacturing bio-electrode, and silicon material particle 2020-09-15
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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