Basic information
- CAS
74051-84-6- Standard SMILES
CCCCCCCCCCC(CCCCCCCC)COC(C)=O- InChIKey
WHCASFSSRGWZGS-UHFFFAOYSA-N- Molecular formula
- C22H44O2
- Average molar mass
- 340.6 g/mol
- Monoisotopic mass
- 340.33413064
Names & identifiers
- Preferred name
- 1-Dodecanol, 2-octyl-, 1-acetate
- IUPAC
- 2-octyldodecyl acetate
- English name
- 2-octyldodecyl acetate
- Molecular formula
- C22H44O2
- Molecular weight
- 340.58
Names & synonyms
2-Octyldodecyl acetate2-Octyl-1-dodecanol acetate1-Dodecanol, 2-octyl-, 1-acetateEINECS 277-684-4DTXSID80888424RefChem:75642DTXCID401027702277-684-4WHCASFSSRGWZGS-UHFFFAOYSA-N74051-84-61-Dodecanol, 2-octyl-, acetate2-Octyldodecane-1-yl acetate
Show more names
SCHEMBL19025446DB-203474NS00061384
Database identifiers
- CAS
74051-84-6- PubChem CID
- 173239
- DTXSID
DTXSID80888424- EC Number
- 277-684-4
- Nikkaji
- J318.904J
Properties
Computed structural properties
- XLogP
- 9.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 19
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 263
Physicochemical properties
- LogP
- 9.8 · 9.800 (est)
- EPA Substance Registry System
- 1 · 1-Dodecanol, 2-octyl-, acetate (74051-84-6)
- 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.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 1-Dodecanol, 2-octyl-, acetate
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Dodecanol, 2-octyl-, 1-acetate: INACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers3 total
山东博洛达生物科技有限公司0531-68651502 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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