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Details

Stereochemistry RACEMIC
Molecular Formula C6H16NO.Cl
Molecular Weight 153.65
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-METHYLCHOLINE CHLORIDE

SMILES

[Cl-].CC(O)C[N+](C)(C)C

InChI

InChIKey=RUUHDEGJEGHQKL-UHFFFAOYSA-M
InChI=1S/C6H16NO.ClH/c1-6(8)5-7(2,3)4;/h6,8H,5H2,1-4H3;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 C6H15NO
Molecular Weight 117.1894
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:44:59 GMT 2023
Edited
by admin
on Sat Dec 16 09:44:59 GMT 2023
Record UNII
K72A0BR9CQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-METHYLCHOLINE CHLORIDE
Common Name English
1-PROPANAMINIUM, 2-HYDROXY-N,N,N-TRIMETHYL-, CHLORIDE
Systematic Name English
(2-HYDROXYPROPYL)TRIMETHYLAMMONIUM CHLORIDE
Systematic Name English
AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-, CHLORIDE
Systematic Name English
.BETA.-HYDROXYPROPYLTRIMETHYLAMMONIUM CHLORIDE
Systematic Name English
BETA-METHYLCHOLINE CHLORIDE [USP-RS]
Common Name English
2-HYDROXY-N,N,N-TRIMETHYLPROPAN-1-AMINIUM CHLORIDE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00883835
Created by admin on Sat Dec 16 09:44:59 GMT 2023 , Edited by admin on Sat Dec 16 09:44:59 GMT 2023
PRIMARY
RS_ITEM_NUM
1424511
Created by admin on Sat Dec 16 09:44:59 GMT 2023 , Edited by admin on Sat Dec 16 09:44:59 GMT 2023
PRIMARY
PUBCHEM
16941
Created by admin on Sat Dec 16 09:44:59 GMT 2023 , Edited by admin on Sat Dec 16 09:44:59 GMT 2023
PRIMARY
CAS
2382-43-6
Created by admin on Sat Dec 16 09:44:59 GMT 2023 , Edited by admin on Sat Dec 16 09:44:59 GMT 2023
PRIMARY
FDA UNII
K72A0BR9CQ
Created by admin on Sat Dec 16 09:44:59 GMT 2023 , Edited by admin on Sat Dec 16 09:44:59 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE