1-Hexylpyridinium bromide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H18N.Br
Molecular Weight	244.171
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Br-].CCCCCC[N+]1=CC=CC=C1

InChI

InChIKey=SZRSEFNUSHACPD-UHFFFAOYSA-M

InChI=1S/C11H18N.BrH/c1-2-3-4-6-9-12-10-7-5-8-11-12;/h5,7-8,10-11H,2-4,6,9H2,1H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C11H18N
Molecular Weight	164.2673
Charge	1
Count

Stereochemistry	ACHIRAL
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 10:42:59 GMT 2023` Edited by `admin` on `Sat Dec 16 10:42:59 GMT 2023`
Record UNII	N7AT59Q225
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-Hexylpyridinium bromide

Systematic Name

English

Pyridinium, 1-hexyl-, bromide (1:1)

Systematic Name

English

N-Hexylpyridinium bromide

Systematic Name

English

Code System Code Type Description

FDA UNII

N7AT59Q225

Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023

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CAS

74440-81-6

Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023

PRIMARY

EPA CompTox

DTXSID7047934

Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023

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PUBCHEM

2734239

Created by admin on Sat Dec 16 10:42:59 GMT 2023 , Edited by admin on Sat Dec 16 10:42:59 GMT 2023

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Related Record Type Details


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1-Hexylpyridinium

PARENT -> SALT/SOLVATE

Amount: