Dimethyl Behenamine
Basic information
- CAS
21542-96-1- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCN(C)C- InChIKey
ICZKASVWFUJTEI-UHFFFAOYSA-N- Molecular formula
- C24H51N
- Average molar mass
- 353.7 g/mol
- Monoisotopic mass
- 353.40215063
Names & identifiers
- Preferred name
- Dimethyl Behenamine
- IUPAC
- N,N-dimethyldocosan-1-amine
- English name
- N,N-dimethyldocosylamine
- Molecular formula
- C24H51N
- Molecular weight
- 353.67
Names & synonyms
21542-96-1N,N-Dimethyldocosylamine1-Docosanamine, N,N-dimethyl-Dimethyl behenaminedimethylbehenylamineDocosylamine, N,N-dimethyl-6WE07WH28AEINECS 244-433-5N-DOCOSYLDIMETHYLAMINEFARMIN DM 2285DTXSID2074588EC 244-433-5
Show more names
DMA22FENTAMINE DMA22DimethyldocosylamineErucyl dimethyl amineN,N-Dimethyl-1-docosanamine
RefChem:588251DTXCID0036500DIMETHYL BEHENAMINE [INCI]244-433-5n,n-dimethyldocosan-1-aminedocosyldimethylaminebehenyl dimethylamineN,N-dimethyldocosanamine
Database identifiers
- CAS
21542-96-1- PubChem CID
- 88942
- DTXSID
DTXSID2074588- UNII
- 6WE07WH28A
- EC Number
- 244-433-5、924-479-9
- Nikkaji
- J226.224J
Properties
Computed structural properties
- XLogP
- 11.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 21
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 224
Experimental & physicochemical properties
Cosmetics
Cosmetic ingredients (Dimethyl Behenamine) -> CIR (Cosmetic Ingredient Review)
Hair conditioning; Antistatic
Personal care product -> emollient -> DIMLA: dimethyl lauryl amine
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 44 °C · 44°C
- Boiling point
- 387.04 °C · 387.04°C (rough estimate)
- Density
- 0.8153 · 0.8153 (estimate)
- vapor pressure
- 0 Pa · 0Pa at 20℃
- refractive index
- 1.4635 · 1.4635 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- pka
- 9.78 · 9.78±0.28(Predicted)
- form
- Solid
- Cosmetics Ingredients Functions
- ANTISTATICHAIR CONDITIONING
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 90 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H302: Harmful if swallowed [Warning Acute toxicity, oral]
Hazard information
Regulatory Information
Chemical: 1-Docosanamine, N,N-dimethyl-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: N,N-dimethyldocosylamine (EC: 244-433-5)
1-Docosanamine, N,N-dimethyl-: 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.
Other Safety InformationIMAP assessments - Tertiary aliphatic (C12-22) and fatty amines: Human health tier II assessment
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute toxicity - category 4
Toxicology
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
Safety data
Chemistry & industry
Uses & manufacturing
UsesCIR ingredient: Dimethyl Behenamine
Use ClassificationCosmetics -> Hair conditioning; Antistatic
General Manufacturing Information1-Docosanamine, N,N-dimethyl-: ACTIVE
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
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Compound notes
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