Basic information
- CAS
1725-01-5- Standard SMILES
O=C1CCCCCCCCOCCCCCCO1- InChIKey
MZLRFHKWWCSGHB-UHFFFAOYSA-N- Molecular formula
- C15H28O3
- Average molar mass
- 256.38 g/mol
- Monoisotopic mass
- 256.20384475
Overview
structure in first source
Names & identifiers
- Preferred name
- 10-Oxahexadecanolide
- IUPAC
- 1,8-dioxacycloheptadecan-9-one
- English name
- 10-OXAHEXADECANOLIDE
- Molecular formula
- C15H28O3
- Molecular weight
- 256.38
Names & synonyms
10-OxahexadecanolideRefChem:776181,8-Dioxacycloheptadecan-9-one1725-01-5OxalideFZF9KV5GWYEINECS 217-033-3BRN 1344777musk nonaneOxalide T9-((6-Hydroxyhexyl)oxy)nonanoic acid omicron-lactoneUNII-FZF9KV5GWY
Show more names
10-Oxadecanolide10-oxa-16-hexadecanolide1,8-Dioxacycloheptadecan-9-on1,8-Dioxacyploheptadecan-9-one1,8-Dioxacycloheptadecan-9-one USP/EP/BP16-Hydroxy-10-oxahexadecanoic acid lactone
SCHEMBL273031DTXSID5051789MZLRFHKWWCSGHB-UHFFFAOYSA-NAKOS015910635DS-021015NS00013097
Database identifiers
- CAS
1725-01-5- PubChem CID
- 74408
- DTXSID
DTXSID5051789- UNII
- FZF9KV5GWY
- EC Number
- 217-033-3
- Nikkaji
- J52.362C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 204
Experimental & physicochemical properties
FragrancesFragrance Ingredient (10-Oxahexadecanolide) -> IFRA transparency List
Physicochemical properties
- Boiling point
- 339.62 °C · 339.62°C (rough estimate)
- Density
- 1.0509 · 1.0509 (rough estimate)
- refractive index
- 1.45 · 1.4500 (estimate)
- Odor
- Sweet musk
- Odor Type
- musk
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 3.531 · 3.531 (est)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 9 KV5GWY · FZF9KV5GWY
- EPA Substance Registry System
- 1 · 1,8-Dioxacycloheptadecan-9-one (1725-01-5)
- Hazard statements
- 412 · H412
- Precautionary statements
- 273 · P273-P501
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 86.2% (225 of 261) of all reports.
H412 (13.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 261 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 1,8-Dioxacycloheptadecan-9-one
1,8-Dioxacycloheptadecan-9-one: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 1,8-Dioxacycloheptadecan-9-one: Human health tier I assessment
Hazard Classes and CategoriesAquatic Chronic 3 (13.8%)
Safety data
- tsca
- TSCA listed
- Toxicity
- LDLo orl-rat: 5 g/kg FCTOD7 30,99S,92
- Hazard statements
- H412
- Precautionary statements
- P273-P501
Chemistry & industry
Uses & manufacturing
Use ClassificationFragrance Ingredients
General Manufacturing Information1,8-Dioxacycloheptadecan-9-one: ACTIVE
Suppliers7 total
上海竹田化工科技有限公司+86-021-33561011 13818804961 · [email protected]
BOC Sciences[email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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