1,3,5-Trimethyl-1-cyclohexene, cis & trans-
Basic information
- CAS
3643-64-9- Standard SMILES
CC1=CC(C)CC(C)C1- InChIKey
PKHOIUJRGGWFEF-UHFFFAOYSA-N- Molecular formula
- C9H16
- Average molar mass
- 124.22 g/mol
- Monoisotopic mass
- 124.12520051
Overview
See other relationships...
Names & identifiers
- Preferred name
- 1,3,5-Trimethyl-1-cyclohexene, cis & trans-
- IUPAC
- 1,3,5-trimethylcyclohexene
- English name
- 1,3,5-trimethyl-1-cyclohexene
- Molecular weight
- 0
Names & synonyms
1,3,5-Trimethyl-1-cyclohexene, cis & trans-RefChem:1052591Cyclohexene, 1,3,5-trimethyl-3643-64-91,3,5-trimethylcyclohex-1-ene1,3,5-TRIMETHYL-1-CYCLOHEXENEtetrahydromesityleneSCHEMBL718948SCHEMBL4450534SCHEMBL11234794SCHEMBL29127589DTXSID20871895
Show more names
1,3,5-Trimethyl-1-cyclohexene,c&t
Database identifiers
- CAS
3643-64-9- PubChem CID
- 15716
- DTXSID
DTXSID20871895- Nikkaji
- J797.753K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 122
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- -91.55 °C · -91.55°C (estimate)
- Boiling point
- 151.06 °C · 151.06°C (estimate)
- Density
- 0.8025 · 0.8025
- refractive index
- 1.449 · 1.4490
- Symbol(GHS)
- 7 · GHS07,GHS02
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H226-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- RIDADR
- 1993 · 1993
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- ridadr
- 1993
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS02
- hazard_class
- 3.2
- packing_group
- III
- Hazard statements
- H315-H335-H226-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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