1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1) supplier

Name
1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1)
EINECS
CAS No. 54541-46-7
Density
Solubility
Melting Point
Formula C₆H₁₄ClNO
Boiling Point
Molecular Weight 116.1809
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (9CI);Acetonyltrimethylammonium chloride(7CI);
PSA
LogP

1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1) Specification

The 1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1), with the CAS registry number 54541-46-7, is also known as NSC83556. This chemical's molecular formula is C₆H₁₄ClNO and molecular weight is 116.1809. Its IUPAC name is called trimethyl(2-oxopropyl)azanium chloride.

Physical properties of 1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1): (1)ACD/LogP: -3.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.13; (4)ACD/LogD (pH 7.4): -3.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C[N+](C)(C)C.[Cl-]
(2)InChI: InChI=1S/C6H14NO.ClH/c1-6(8)5-7(2,3)4;/h5H2,1-4H3;1H/q+1;/p-1
(3)InChIKey: DOTQEKRZRYAIDV-UHFFFAOYSA-M

Product Name

1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1)

1-Propanaminium,N,N,N-trimethyl-2-oxo-, chloride (1:1) Specification

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