1,1,3,5-Tetramethylcyclohexane
Basic information
- CAS
4306-65-4- Standard SMILES
CC1CC(C)CC(C)(C)C1- InChIKey
WOJSMJIXPQLESQ-UHFFFAOYSA-N- Molecular formula
- C10H20
- Average molar mass
- 140.27 g/mol
- Monoisotopic mass
- 140.15650064
Names & identifiers
- Preferred name
- 1,1,3,5-Tetramethylcyclohexane
- IUPAC
- 1,1,3,5-tetramethylcyclohexane
- English name
- 1,1,3,5-Tetramethylcyclohexane
- Molecular formula
- C10H20
- Molecular weight
- 140.27
Names & synonyms
1,1,3,5-Tetramethylcyclohexane4306-65-4DTXSID00871393RefChem:409641DTXCID30819061691-529-1MFCD00060820Cyclohexane, 1,1,3,5-tetramethyl-1,1,3,5-Tetramethyl cyclohexanecis-1,1,3,5-TetramethylcyclohexneCyclohexne, 1,1,3,5-tetramethyl-, cis-Cyclohexane, 1,1,3,5-tetramethyl-, (3R,5R)-rel-
Show more names
Tetramethylcyclohexane1,1,3,5-TETRAMETHYLCYCLOHEXANE 96+%
SCHEMBL597801SCHEMBL2529969SCHEMBL5918165SCHEMBL6554381SCHEMBL10365205SCHEMBL10581718AKOS025295321SY054528
Database identifiers
- CAS
4306-65-4、50876-31-8、50876-32-9- PubChem CID
- 107263
- DTXSID
DTXSID00871393- EC Number
- 691-529-1
- Nikkaji
- J336.177B
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Boiling point
- 148 °C · 148 °C / 260mmHg
- Density
- 0.79 · 0.79
- refractive index
- 1.433 to · 1.4330 to 1.4350
- Flash point
- 52 °C · 52 °C
- form
- clear liquid
- color
- Colorless to Almost colorless
- LogP
- 5.15 · 5.150 (est)
- EPA Substance Registry System
- 1 · Cyclohexane, 1,1,3,5-tetramethyl- (4306-65-4)
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 226 · H226
- Precautionary statements
- 501 · P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P303+P361+P353-P403+P235
- RIDADR
- 3295 · UN 3295 3/PG III
- HS Code
- 2902.19 · 2902.19.0050
- HazardClass
- 3 · 3
- 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.
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- ridadr
- UN 3295 3/PG III
- hs_code
- 2902.19.0050
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- hazard_class
- 3
- packing_group
- III
- Hazard statements
- H226
- Precautionary statements
- P501-P240-P210-P233-P243-P241-P242-P280-P370+P378-P303+P361+P353-P403+P235
Suppliers
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Related reactions
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Compound notes
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