Basic information
- CAS
593-50-0- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO- InChIKey
REZQBEBOWJAQKS-UHFFFAOYSA-N- Molecular formula
- C30H62O
- Average molar mass
- 438.8 g/mol
- Monoisotopic mass
- 438.4800666
Overview
Triacontan-1-ol is an ultra-long-chain primary fatty alcohol that is triacontane in which one of the terminal methyl hydrogens is replaced by a hydroxy group. It is an ultra-long-chain primary fatty alcohol and a fatty alcohol 30:0.
Names & identifiers
- Preferred name
- 1-Triacontanol
- IUPAC
- triacontan-1-ol
- English name
- 1-Triacontanol
- Molecular formula
- C30H62O
- Molecular weight
- 438.81
Names & synonyms
1-TriacontanolTriacontan-1-ol593-50-0Melissyl alcoholMyricyl alcoholn-TriacontanolTriacontyl alcoholmiraculan1-HydroxytriacontaneWell-BloomULTRIA767RD0E90B
Show more names
TATRIACONTANOLtriacon-10TORANutronmyricyl
NSC405588NSC-402492NSC-405588DTXSID5029188CHEBI:28409NSC402492RefChem:25826DTXCID709188
Database identifiers
- CAS
593-50-0- PubChem CID
- 68972
- DTXSID
DTXSID5029188- ChEMBL
CHEMBL1079147- ChEBI
CHEBI:28409- UNII
- 767RD0E90B
- EC Number
- 209-794-5
- Nikkaji
- J6.767I
Properties
Computed structural properties
- XLogP
- 14.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 28
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 288
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty alcohols [FA05]
PolymersOther Classes -> Alcohols and Polyols, Other
CosmeticsViscosity controlling
Physical DescriptionSolid; [Merck Index] Slightly beige powder; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- 86 · 86-87 °C(lit.)
- Boiling point
- 480.56 °C · 480.56°C (rough estimate)
- Density
- 0.8672 · 0.8672 (rough estimate)
- refractive index
- 1.4604 · 1.4604 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Benzene (Slightly), Chloroform (Slightly, Heated)
- pka
- 15.2 · 15.20±0.10(Predicted)
- form
- Flakes
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 75% (3 of 4) of all reports.
Warning
H315 (25%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 1-Triacontanol
1-Triacontanol: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 1-Triacontanol: Human health tier I assessment
Hazards SummaryMay cause irritation; [Acros Organics MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (25%)
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- -
- tsca
- TSCA listed
- hs_code
- 29051990
- safety_code
- 24/25
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Uses & manufacturing
Uses
The palmitate is found in plant waxes and beeswax; Used as a plant growth regulator; [Merck Index]
Formerly registered in the US for use as a plant growth regulator; [NPIRS]
Farming (Pesticides) [Category: Industry]
Use ClassificationCosmetics -> Viscosity controlling
General Manufacturing Information1-Triacontanol: ACTIVE
Applications
UsesIt was reported to be a new naturally occurring plant-growth regulator. Present in plant cuticle waxes and in beeswax as the palmitate.
Upstream & downstream products
Upstream raw materials
Related reactions
3 records
Compound notes
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