CAS No.871-37-4,(carboxymethyl)dimethyloleylammonium hydroxide Suppliers

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Basic Information

Molecular Structure:
CAS No.:	871-37-4
Name:	(carboxymethyl)dimethyloleylammonium hydroxide

Formula:	C₂₂H₄₃NO₂
Molecular Weight:	353.58
Synonyms:	9-Octadecen-1-aminium,N-(carboxymethyl)-N,N-dimethyl-, hydroxide, inner salt, (Z)-;9-Octadecen-1-aminium,N-(carboxymethyl)-N,N-dimethyl-, inner salt, (Z)-;Chembetaine oleyl;Mackam OB30;N-(Carboxymethyl)-N-(cis-9-octadecenyl)dimethylammonium hydroxide innersalt;Oleyl betaine;Rikabion A 300;Standapol OLB 50;Velvetex OLB 50;
EINECS:	212-806-1
PSA:	40.13000
LogP:	4.85020

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Specification

This chemical is called N-(Carboxymethyl)-N,N-dimethyl-9-octadecen-1-aminium hydroxide, inner salt, and it can also be named as 9-Octadecen-1-aminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt,(9Z)-. With the molecular formula of C₂₂H₄₃NO₂, its molecular weight is 353.58. The CAS registry number of this chemical is 871-37-4.

Other characteristics of the N-(Carboxymethyl)-N,N-dimethyl-9-octadecen-1-aminium hydroxide, inner salt can be summarised as followings: (1)ACD/LogP: 3.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.88; (4)ACD/LogD (pH 7.4): 3.88; (5)ACD/BCF (pH 5.5): 730.48; (6)ACD/BCF (pH 7.4): 730.59; (7)ACD/KOC (pH 5.5): 5779.36; (8)ACD/KOC (pH 7.4): 5780.22; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 18; (12)Polar Surface Area: 37.3 Å².

You can still convert the following datas into molecular structure:
1.SMILES: [O-]C(=O)C[N+](CCCCCCCC\C=C/CCCCCCCC)(C)C
2.InChI: InChI=1/C22H43NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22(24)25/h11-12H,4-10,13-21H2,1-3H3/b12-11-
3.InChIKey: AMRBZKOCOOPYNY-QXMHVHEDBE