METHYLTRICAPRYLYLAMMONIUM BROMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H54N.Br
Molecular Weight	448.607
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYLTRICAPRYLYLAMMONIUM BROMIDE

Structure Search

SMILES

[Br-].CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC

InChI

InChIKey=QLPMKRZYJPNIRP-UHFFFAOYSA-M

InChI=1S/C25H54N.BrH/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3;/h5-25H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C25H54N
Molecular Weight	368.703
Charge	1
Count

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

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
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 `Sat Dec 16 11:09:41 GMT 2023` Edited by `admin` on `Sat Dec 16 11:09:41 GMT 2023`
Record UNII	I5T6470120
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYLTRICAPRYLYLAMMONIUM BROMIDE

Systematic Name

English

TRIOCTYLMETHYLAMMONIUM BROMIDE

Systematic Name

English

1-OCTANAMINIUM, N-METHYL-N,N-DIOCTYL-, BROMIDE

Systematic Name

English

ALIQUAT 138

Brand Name

English

1-OCTANAMINIUM, N-METHYL-N,N-DIOCTYL-, BROMIDE (1:1)

Systematic Name

English

METHYLTRIOCTYLAMMONIUM BROMIDE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70467681

Created by admin on Sat Dec 16 11:09:41 GMT 2023 , Edited by admin on Sat Dec 16 11:09:41 GMT 2023

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CAS

35675-80-0

Created by admin on Sat Dec 16 11:09:41 GMT 2023 , Edited by admin on Sat Dec 16 11:09:41 GMT 2023

PRIMARY

FDA UNII

I5T6470120

Created by admin on Sat Dec 16 11:09:41 GMT 2023 , Edited by admin on Sat Dec 16 11:09:41 GMT 2023

PRIMARY

PUBCHEM

11503288

Created by admin on Sat Dec 16 11:09:41 GMT 2023 , Edited by admin on Sat Dec 16 11:09:41 GMT 2023

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METHYLTRICAPRYLYLAMMONIUM

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