DISTEARYL EPOXYPROPYLMONIUM CHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C40H82NO.Cl
Molecular Weight	628.538
Optical Activity	( + / - )
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DISTEARYL EPOXYPROPYLMONIUM CHLORIDE

Structure Search

SMILES

[Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCCCC)CC1CO1

InChI

InChIKey=SWNGALCHGNUWKW-UHFFFAOYSA-M

InChI=1S/C40H82NO.ClH/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41(3,38-40-39-42-40)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;/h40H,4-39H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C40H82NO
Molecular Weight	593.0852
Charge	1
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:16:46 GMT 2025` Edited by `admin` on `Mon Mar 31 23:16:46 GMT 2025`
Record UNII	BDL7FFT2PU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DISTEARYL EPOXYPROPYLMONIUM CHLORIDE

Official Name

English

2-OXIRANEMETHANAMINIUM, N-METHYL-N,N-DIOCTADECYL-, CHLORIDE (1:1)

Preferred Name

English

AMMONIUM, (2,3-EPOXYPROPYL)METHYLDIOCTADECYL-, CHLORIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

BDL7FFT2PU

Created by admin on Mon Mar 31 23:16:46 GMT 2025 , Edited by admin on Mon Mar 31 23:16:46 GMT 2025

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EPA CompTox

DTXSID801021320

Created by admin on Mon Mar 31 23:16:46 GMT 2025 , Edited by admin on Mon Mar 31 23:16:46 GMT 2025

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CAS

29681-28-5

Created by admin on Mon Mar 31 23:16:46 GMT 2025 , Edited by admin on Mon Mar 31 23:16:46 GMT 2025

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PUBCHEM

57483147

Created by admin on Mon Mar 31 23:16:46 GMT 2025 , Edited by admin on Mon Mar 31 23:16:46 GMT 2025

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