Octadecylazanium;acetate
Basic information
- CAS
2190-04-7- Standard SMILES
CC(=O)[O-].CCCCCCCCCCCCCCCCCC[NH3+]- InChIKey
UPHWVVKYDQHTCF-UHFFFAOYSA-N- Molecular formula
- C20H43NO2
- Average molar mass
- 329.6 g/mol
- Monoisotopic mass
- 329.32937961
Overview
See also: Stearylamine acetate (preferred).
Names & identifiers
- Preferred name
- Octadecylazanium;acetate
- IUPAC
- octadecylazanium acetate
- English name
- Stearylamine acetate
- Molecular formula
- C20H43NO2
- Molecular weight
- 329.57
Names & synonyms
octadecylazanium;acetateUNII-856J14021AAcetic acid, compound with octadecylamineNS00083345Nsc81938Armac 18DAlamac 7dCation SANoramac SNissan Cation SAStearylamine acetateOCTADECYLAMINE ACETATE
Show more names
StearylammoniumacetateOctadecanamine acetate
Database identifiers
- CAS
2190-04-7- PubChem CID
- 16608
Properties
Computed structural properties
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Melting point
- 75 °C · 75 °C
- Flash point
- 75 °C · 75 °C
- form
- powder to crystal
- color
- White to Orange to Green
- InChI
- InChI=1S/C18H39N.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-2(3)4/h2-19H2,1H3;1H3,(H,3,4)
- InChIKey
- UPHWVVKYDQHTCF-UHFFFAOYSA-N
- SMILES
- C(=O)(O)C.C(CCCCCCCCN)CCCCCCCCC
- FDA UNII
- 856 J14021A · 856J14021A
- EPA Substance Registry System
- 1 · 1-Octadecanamine, acetate (2190-04-7)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- Risk Statements
- 22 · 22
- Safety Statements
- 20 · 20-35
- RTECS
- 4170000 · RG4170000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- rtecs
- RG4170000
- hs_code
- 29211990
- Toxicity
- LD50 orl-mus: 1000 mg/kg CHTPBA 1,11,65
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 20-35
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
UsesSTEARYLAMINE ACETATE is used as a metal corrosion inhibitor, fertilizer anti-caking agent, mineral flotation agent, etc.
Suppliers
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Related reactions
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Compound notes
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