N,N'-Hexane-1,6-diylbis(bis(2-hydroxyethyl)methylammonium) dichloride

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H38N2O4.2Cl
Molecular Weight	393.39
Optical Activity	NONE
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N'-Hexane-1,6-diylbis(bis(2-hydroxyethyl)methylammonium) dichloride

Structure Search

SMILES

[Cl-].[Cl-].C[N+](CCO)(CCO)CCCCCC[N+](C)(CCO)CCO

InChI

InChIKey=IHVSQBNDJWNQNE-UHFFFAOYSA-L

InChI=1S/C16H38N2O4.2ClH/c1-17(9-13-19,10-14-20)7-5-3-4-6-8-18(2,11-15-21)12-16-22;;/h19-22H,3-16H2,1-2H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula	C16H38N2O4
Molecular Weight	322.4839
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Cl
Molecular Weight	35.453
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:31:59 GMT 2025` Edited by `admin` on `Wed Apr 02 20:31:59 GMT 2025`
Record UNII	QX2P8Y3GCF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N'-Hexane-1,6-diylbis(bis(2-hydroxyethyl)methylammonium) dichloride

Systematic Name

English

1,6-Hexanediaminium, N<sup>1</sup>,N<sup>1</sup>,N<sup>6</sup>,N<sup>6</sup>-tetrakis(2-hydroxyethyl)-N<sup>1</sup>,N<sup>6</sup>-dimethyl-, chloride (1:2)

Preferred Name

English

Code System Code Type Description

CAS

85117-93-7

Created by admin on Wed Apr 02 20:31:59 GMT 2025 , Edited by admin on Wed Apr 02 20:31:59 GMT 2025

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EPA CompTox

DTXSID90234236

Created by admin on Wed Apr 02 20:31:59 GMT 2025 , Edited by admin on Wed Apr 02 20:31:59 GMT 2025

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ECHA (EC/EINECS)

285-644-2

Created by admin on Wed Apr 02 20:31:59 GMT 2025 , Edited by admin on Wed Apr 02 20:31:59 GMT 2025

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FDA UNII

QX2P8Y3GCF

Created by admin on Wed Apr 02 20:31:59 GMT 2025 , Edited by admin on Wed Apr 02 20:31:59 GMT 2025

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PUBCHEM

56842640

Created by admin on Wed Apr 02 20:31:59 GMT 2025 , Edited by admin on Wed Apr 02 20:31:59 GMT 2025

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