-
Name
diethylmethyl[3-[(1-oxooctadecyl)amino]propyl]ammonium chloride
- EINECS 303-306-5
- CAS No. 94160-23-3
- Density
- Solubility
- Melting Point
- Formula C26H55ClN2O
- Boiling Point 541.6°C at 760 mmHg
- Molecular Weight 447.1807
- Flash Point 112.7°C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 1-Propanaminium,N,N-diethyl-N-methyl-3-[(1-oxooctadecyl)amino]-, chloride (9CI);
- PSA 35.42000
- LogP 8.75540
1-Propanaminium,N,N-diethyl-N-methyl-3-[(1-oxooctadecyl)amino]-, chloride (1:1) Specification
The 1-Propanaminium,N,N-diethyl-N-methyl-3-[(1-oxooctadecyl)amino]-, chloride (1:1), with the CAS registry number 94160-23-3, is also known as Diethylmethyl(3-((1-oxooctadecyl)amino)propyl)ammonium chloride. Its EINECS registry number is 303-306-5. This chemical's molecular formula is C26H55ClN2O and molecular weight is 447.1807. Its IUPAC name is called diethyl-methyl-[3-(octadecanoylamino)propyl]azanium chloride.
Physical properties of 1-Propanaminium,N,N-diethyl-N-methyl-3-[(1-oxooctadecyl)amino]-, chloride (1:1): (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 2; (3)Rotatable Bond Count: 22; (4)Tautomer Count: 2; (5)Exact Mass: 446.400292; (6)MonoIsotopic Mass: 446.400292; (7)Topological Polar Surface Area: 29.1; (8)Heavy Atom Count: 30; (9)Formal Charge: 0; (10)Complexity: 353; (11)Isotope Atom Count: 0; (12)Defined Atom StereoCenter Count: 0; (13)Undefined Atom StereoCenter Count: 0; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 2.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(CC)CC.[Cl-]
(2)InChI: InChI=1S/C26H54N2O.ClH/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-26(29)27-24-22-25-28(4,6-2)7-3;/h5-25H2,1-4H3;1H
(3)InChIKey: AUSNCNLXNKNARV-UHFFFAOYSA-N
Related Products
- 1-Propanaminium, 3-carboxy-2-(2,2-dimethyl-1-oxopropoxy)-N,N,N-trimethyl-, chloride, (R)-
- 1-Propanaminium, 3-carboxy-2-(2-carboxy-1-oxopropoxy)-N,N,N-trimethyl-, inner salt, (2R)-
- 1-Propanaminium, 3-carboxy-2-[(carboxyacetyl)oxy
- 1-Propanaminium, 3-carboxy-2-[(carboxyacetyl)oxy]-N,N,N-trimethyl-, inner salt, (2R)-
- 1-Propanaminium,2-(acetyloxy)-3-carboxy-N,N,N-trimethyl-, chloride (1:1)
- 1-Propanaminium,2-hydroxy-N,N,N-trimethyl-
- 1-Propanaminium,2-hydroxy-N,N-dimethyl-N-[3-[(1-oxododecyl)amino]propyl]-3-sulfo-, inner salt
- 1-Propanaminium,3,3'-[(2,4-diphenyl-1,3-cyclobutanediyl)bis(carbonyloxy)]bis[N,N,N-trimethyl-,diiodide, (1a,2a,3b,4b)- (9CI)
- 1-Propanaminium,3-carboxy-2-(2-carboxy-1-oxopropoxy)-N,N,N-trimethyl-, chloride
- 1-Propanaminium,3-carboxy-2-hydroxy-N,N,N-trimethyl-, inner salt, (2S)-
- 94160-27-7
- 94160-40-4
- 941607-78-9
- 94166-45-7
- 94166-50-4
- 94166-53-7
- 94166-58-2
- 94166-62-8
- 94166-64-0
- 94166-66-2
Hot Products
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View