Basic information
- CAS
1454-84-8- Standard SMILES
CCCCCCCCCCCCCCCCCCCO- InChIKey
XGFDHKJUZCCPKQ-UHFFFAOYSA-N- Molecular formula
- C19H40O
- Average molar mass
- 284.5 g/mol
- Monoisotopic mass
- 284.3079159
Overview
Nonadecan-1-ol is a long-chain primary fatty alcohol that is nonadecane in which one of the terminal methyl hydrogens is replaced by a hydroxy group. It has a role as a volatile oil component, a plant metabolite and a fungal metabolite. It is a nonadecanol and a long-chain primary fatty alcohol.
Names & identifiers
- Preferred name
- 1-Nonadecanol
- IUPAC
- nonadecan-1-ol
- English name
- 1-NONADECANOL
- Molecular formula
- C19H40O
- Molecular weight
- 284.52
Names & synonyms
1-NONADECANOLNonadecan-1-olNONADECANOLNonadecyl alcoholn-Nonadecanol-1n-nonadecyl alcoholUNII-A465X576KOA465X576KOEINECS 215-930-4AI3-36471DTXSID90870875Nonadecan1ol
Show more names
ALCOHOL C191-NONDECANOLNonadecanol-(1)1-Nonadecanol>Nonadecanol, 99+%
RefChem:76626DTXCID1081855752783-43-4XGFDHKJUZCCPKQ-UHFFFAOYSA-N1454-84-8MFCD00002824n-Nonadecanol1-Nonadecanol; Nonadecyl alcohol; n-1-Nonadecanol; n-Nonadecanol
Database identifiers
- CAS
1454-84-8- PubChem CID
- 80281
- DTXSID
DTXSID90870875- ChEBI
CHEBI:197470- UNII
- A465X576KO
- EC Number
- 215-930-4
- Nikkaji
- J45.980A
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 17
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 156
Experimental & physicochemical properties
PolymersOther Classes -> Alcohols and Polyols, Other
Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionWhite flakes; [Aldrich MSDS]
Physicochemical properties
- Melting point
- 60 · 60-61 °C (lit.)
- Boiling point
- 156 °C · 156 °C (0.1 mmHg)
- Density
- 0.8528 · 0.8528 (estimate)
- refractive index
- 1.4328 · 1.4328
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform (Slightly), Methanol (Slightly, Sonicated)
- pka
- 15.2 · 15.20±0.10(Predicted)
- form
- Liquid
- color
- Off-White
- BRN
- 1758190 · 1758190
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% (3 of 3) of all reports.
Not Classified
Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information1-Nonadecanol: 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.
Hazards Summary
Aliphatic alcohols are metabolized and eliminated efficiently; Not skin sensitizers; May have low-grade liver effects; CNS depression seen in shorter chain alcohols, e.g., 1-hexanol and 1-octanol; [Reference #1] May cause irritation; [Aldrich MSDS] See 1-Docosanol.
Hazard Classes and CategoriesNot Classified
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 2905.16.0050
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
Uses1-Nonadecanol was used as an internal standard in the study of coprostanol in sediments.
General Description1-Nonadecanol is one of the constituents of supercritical carbon dioxide (SC-CO2) essential oil of freshly collected aerial parts of Heracleum thomsonii (Umbeliferae).
Related reactions
2 records
Compound notes
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