METHYL-D9-CHOLINE CHLORIDE

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H14NO.Cl
Molecular Weight	148.679
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Cl-].[2H]C([2H])([2H])[N+](CCO)(C([2H])([2H])[2H])C([2H])([2H])[2H]

InChI

InChIKey=SGMZJAMFUVOLNK-KYRNGWDOSA-M

InChI=1S/C5H14NO.ClH/c1-6(2,3)4-5-7;/h7H,4-5H2,1-3H3;1H/q+1;/p-1/i1D3,2D3,3D3;

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	C5H13NO
Molecular Weight	112.2183
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:14:16 GMT 2025` Edited by `admin` on `Mon Mar 31 23:14:16 GMT 2025`
Record UNII	2Z4659NSZ3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHOLINE-2H9 CHLORIDE

Preferred Name

English

METHYL-D9-CHOLINE CHLORIDE

Common Name

English

CHOLINE-TRI(METHYL-D3), CHLORIDE

Common Name

English

ETHANAMINIUM, 2-HYDROXY-N,N,N-TRI(METHYL-D3)-, CHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90584026

Created by admin on Mon Mar 31 23:14:16 GMT 2025 , Edited by admin on Mon Mar 31 23:14:16 GMT 2025

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FDA UNII

2Z4659NSZ3

Created by admin on Mon Mar 31 23:14:16 GMT 2025 , Edited by admin on Mon Mar 31 23:14:16 GMT 2025

PRIMARY

CAS

61037-86-3

Created by admin on Mon Mar 31 23:14:16 GMT 2025 , Edited by admin on Mon Mar 31 23:14:16 GMT 2025

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PUBCHEM

16213539

Created by admin on Mon Mar 31 23:14:16 GMT 2025 , Edited by admin on Mon Mar 31 23:14:16 GMT 2025

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METHYL-D9-CHOLINE

PARENT -> SALT/SOLVATE