Basic information
- CAS
2437-97-0- Standard SMILES
CC1=CCC2CC1OC2(C)C- InChIKey
SKBXVAOMEVOTGJ-UHFFFAOYSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Overview
Xi-Pinol is a member of oxolanes.
Names & identifiers
- Preferred name
- 6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-
- IUPAC
- 4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene
- English name
- 4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene
- Molecular formula
- C10H16O
- Molecular weight
- 152.23344
Names & synonyms
Pinol2437-97-04,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-enep-Menth-1-ene, 6,8-epoxy-6-Oxabicyclo[3.2.1]oct-3-ene, 4,7,7-trimethyl-EINECS 219-446-4NSC 407159dl-4,7,7-Trimethyl-6-oxabicyclo(3.2.1)oct-3-eneAI3-22990DTXSID908714434,7,7-Trimethyl-6-oxabicyclo(3.2.1)oct-3-ene6-Oxabicyclo(3.2.1)oct-3-ene, 4,7,7-trimethyl-
Show more names
6,8-Epoxy-1-menthene4,7,7-trimethyl-6-oxabicyclo[3.2.1]oct-3-ene,97%
RefChem:544175DTXCID20819111p-Menth-1-ene, 6,8-epoxy-(8CI)219-446-4xi-Pinolp-Menth-1-ene,8-epoxy-6,8-Epoxymenth-1-ene (Pinol)6-Oxabicyclo[3.2.1]oct-3-ene,7,7-trimethyl-
Database identifiers
- CAS
2437-97-0- PubChem CID
- 101153
- DTXSID
DTXSID90871443- ChEBI
CHEBI:171932- EC Number
- 219-446-4
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 203
Physicochemical properties
- Boiling point
- 182 °C · 182 °C(Press: 755 Torr)
- Density
- 0.942 g/cm3 · 0.942 g/cm3(Temp: 19 °C)
- LogP
- 2.598 · 2.598 (est)
- EPA Substance Registry System
- 6 · 6-Oxabicyclo[3.2.1]oct-3-ene, 4,7,7-trimethyl- (2437-97-0)
- 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.
Hazard information
Regulatory InformationChemical: 6-Oxabicyclo[3.2.1]oct-3-ene, 4,7,7-trimethyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Uses & manufacturing
General Manufacturing Information6-Oxabicyclo[3.2.1]oct-3-ene, 4,7,7-trimethyl-: INACTIVE
Suppliers10 total
上海策嵘生物科技有限公司[email protected]
淄博茵泰医药科技有限公司18766946537 · [email protected]
武汉布林科技有限公司3456065315 13260619011 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
郑州艾克姆化工有限公司0371-63315541 13323832564 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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