U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C6H17N2.Cl
Molecular Weight 152.666
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-AMINO-N,N,N-TRIMETHYL-1-PROPANAMINIUM CHLORIDE

SMILES

[Cl-].C[N+](C)(C)CCCN

InChI

InChIKey=SLCCHLCXVOABIB-UHFFFAOYSA-M
InChI=1S/C6H17N2.ClH/c1-8(2,3)6-4-5-7;/h4-7H2,1-3H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C6H17N2
Molecular Weight 117.2126
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:37:19 GMT 2023
Edited
by admin
on Sat Dec 16 10:37:19 GMT 2023
Record UNII
97GVU8Q3I4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-AMINO-N,N,N-TRIMETHYL-1-PROPANAMINIUM CHLORIDE
Systematic Name English
AMMONIUM, (3-AMINOPROPYL)TRIMETHYL-, CHLORIDE
Systematic Name English
(3-AMINOPROPYL)TRIMETHYLAMMONIUM CHLORIDE
Systematic Name English
1-PROPANAMINIUM, 3-AMINO-N,N,N-TRIMETHYL-, CHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
19223-69-9
Created by admin on Sat Dec 16 10:37:19 GMT 2023 , Edited by admin on Sat Dec 16 10:37:19 GMT 2023
PRIMARY
FDA UNII
97GVU8Q3I4
Created by admin on Sat Dec 16 10:37:19 GMT 2023 , Edited by admin on Sat Dec 16 10:37:19 GMT 2023
PRIMARY
PUBCHEM
12478016
Created by admin on Sat Dec 16 10:37:19 GMT 2023 , Edited by admin on Sat Dec 16 10:37:19 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE