Completing data — refresh the page later to see the latest
Basic information
- CAS
472-78-6- Standard SMILES
CC1=CCCC(C)(C)C1C=CC(C)O- InChIKey
PWDOJWCZWKWKSE-UHFFFAOYSA-N- Molecular formula
- C13H22O
- Average molar mass
- 194.318 g/mol
- Monoisotopic mass
- 194.16706532
Names & identifiers
- Preferred name
- 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-
- IUPAC
- 4-(2,6,6-Trimethylcyclohex-2-en-1-yl)but-3-en-2-ol
- English name
- 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol
- Molecular formula
- C13H22O
- Molecular weight
- 194.31
Names & synonyms
Einecs 207-455-61-(1,5,5-Trimethylcyclohexene-6-yl)-1-butene-3-ol1-Methyl-3-(2,4,4-trimethyl-1-cyclohexene-3-yl)-2-propene-1-ol
Database identifiers
- CAS
472-78-6- PubChem CID
- 101696
- DTXSID
DTXSID50865202
Properties
Physicochemical properties
- Boiling point
- 103 °C · 103 °C(Press: 3 Torr)
- Density
- 0.9189 g/cm³ · 0.9189 g/cm³
- pka
- 14.585 · 14.585±0.20(predicted)
- LogP
- 4.492 · 4.492 (est)
- EPA Substance Registry System
- 3 · 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- (472-78-6)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Additional notes
DefinitionChEBI: 4,7-Megastigmadien-9-ol is a sesquiterpenoid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…