ACETYLCHOLINE BROMIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H16NO2.Br
Molecular Weight	226.111
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ACETYLCHOLINE BROMIDE

Structure Search

SMILES

[Br-].CC(=O)OCC[N+](C)(C)C

InChI

InChIKey=ZEHGKSPCAMLJDC-UHFFFAOYSA-M

InChI=1S/C7H16NO2.BrH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C7H16NO2
Molecular Weight	146.2074
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 `Fri Dec 15 15:16:43 UTC 2023` Edited by `admin` on `Fri Dec 15 15:16:43 UTC 2023`
Record UNII	C12HG588IF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACETYLCHOLINE BROMIDE

Systematic Name

English

2-(ACETYLOXY)-N,N,N-TRIMETHYLETHANAMINIUM BROMIDE (1:1)

Systematic Name

English

ACETYLCHOLINE BROMIDE [MI]

Common Name

English

NSC-4678

Code

English

Code System Code Type Description

CAS

66-23-9

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

PRIMARY

ECHA (EC/EINECS)

200-622-4

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

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NSC

4678

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

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PUBCHEM

65551

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

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EPA CompTox

DTXSID60883215

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

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MERCK INDEX

m1351

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

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Merck Index

FDA UNII

C12HG588IF

Created by admin on Fri Dec 15 15:16:43 UTC 2023 , Edited by admin on Fri Dec 15 15:16:43 UTC 2023

PRIMARY

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