13-Oxabicyclo(10.1.0)trideca-4,8-diene, 1,5,9-trimethyl-
Basic information
- CAS
13786-79-3- Standard SMILES
C/C1=C\CCC2(C)OC2CC/C(C)=C/CC1- InChIKey
PAZWFUGWOAQBJJ-SWZPTJTJSA-N- Molecular formula
- C15H24O
- Average molar mass
- 220.35 g/mol
- Monoisotopic mass
- 220.18271539
Names & identifiers
- Preferred name
- 13-Oxabicyclo(10.1.0)trideca-4,8-diene, 1,5,9-trimethyl-
- IUPAC
- (4E,8E)-1,5,9-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
Names & synonyms
EINECS 237-443-61,5,9-TRIMETHYL-13-OXABICYCLO[10.1.0]TRIDECA-4,8-DIENE13786-79-3DTXSID605169713-Oxabicyclo(10.1.0)trideca-4,8-diene, 1,5,9-trimethyl-1,5,9-Trimethyl-13-oxabicyclo(10.1.0)trideca-4,8-diene13-Oxabicyclo[10.1.0]trideca-4,8-diene, 1,5,9-trimethyl-RefChem:236527DTXCID903025213-Oxabicyclo10.1.0trideca-4,8-diene, 1,5,9-trimethyl-237-443-6(4E,8E)-1,5,9-TRIMETHYL-13-OXABICYCLO[10.1.0]TRIDECA-4,8-DIENE
Show more names
(4Z,8Z)-1,5,9-TRIMETHYL-13-OXABICYCLO[10.1.0]TRIDECA-4,8-DIENECedroxydeSCHEMBL4615726NS00013297
Database identifiers
- CAS
13786-79-3- PubChem CID
- 6436727
- DTXSID
DTXSID6051697- EC Number
- 237-443-6
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 313
Experimental & physicochemical properties
FragrancesFragrance Ingredient (1,5,9-Trimethylcyclododeca-1,5,9-triene epoxide) -> IFRA transparency List
Endocrine DisruptorsPotential endocrine disrupting compound
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
This chemical does not meet GHS hazard criteria for 100% (234 of 234) of all reports.
Not Classified
Aggregated GHS information provided per 234 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 13-Oxabicyclo[10.1.0]trideca-4,8-diene, 1,5,9-trimethyl-
13-Oxabicyclo10.1.0trideca-4,8-diene, 1,5,9-trimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Uses & manufacturing
Use ClassificationFragrance Ingredients
General Manufacturing Information13-Oxabicyclo[10.1.0]trideca-4,8-diene, 1,5,9-trimethyl-: ACTIVE
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Compound notes
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