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Details

Stereochemistry ACHIRAL
Molecular Formula C19H42N.C18H35O2
Molecular Weight 568.0128
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CETRIMONIUM STEARATE

SMILES

CCCCCCCCCCCCCCCCCC([O-])=O.CCCCCCCCCCCCCCCC[N+](C)(C)C

InChI

InChIKey=DXQWPBNWAKTXPF-UHFFFAOYSA-M
InChI=1S/C19H42N.C18H36O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-19H2,1-4H3;2-17H2,1H3,(H,19,20)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C18H35O2
Molecular Weight 283.4693
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H42N
Molecular Weight 284.5435
Charge 1
Count
Stereochemistry RACEMIC
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 15:04:50 UTC 2023
Edited
by admin
on Fri Dec 15 15:04:50 UTC 2023
Record UNII
4P1PNM96KR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CETRIMONIUM STEARATE
MI  
Common Name English
HEXADECYLTRIMETHYLAMMONIUM STEARATE
Systematic Name English
STEARIC ACID, ION(1-), HEXADECYLTRIMETHYLAMMONIUM
Systematic Name English
CETRIMONIUM STEARATE [MI]
Common Name English
1-HEXADECANAMINIUM, N,N,N-TRIMETHYL-, OCTADECANOATE (1:1)
Systematic Name English
1-HEXADECANAMINIUM, N,N,N-TRIMETHYL-, OCTADECANOATE
Systematic Name English
TRIMETHYLHEXADECYLAMMONIUM STEARATE
Systematic Name English
CETYLTRIMETHYLAMMONIUM STEARATE
Systematic Name English
AMMONIUM, HEXADECYLTRIMETHYL-, STEARATE
Systematic Name English
OCTADECANOIC ACID, ION(1-), N,N,N-TRIMETHYL-1-HEXADECANAMINIUM
Systematic Name English
CETA STEARATE
Common Name English
N-HEXADECYL-N,N,N-TRIMETHYLAMMONIUM STEARATE
Systematic Name English
Code System Code Type Description
MERCK INDEX
m631
Created by admin on Fri Dec 15 15:04:50 UTC 2023 , Edited by admin on Fri Dec 15 15:04:50 UTC 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
204-691-1
Created by admin on Fri Dec 15 15:04:50 UTC 2023 , Edited by admin on Fri Dec 15 15:04:50 UTC 2023
PRIMARY
FDA UNII
4P1PNM96KR
Created by admin on Fri Dec 15 15:04:50 UTC 2023 , Edited by admin on Fri Dec 15 15:04:50 UTC 2023
PRIMARY
CAS
124-23-2
Created by admin on Fri Dec 15 15:04:50 UTC 2023 , Edited by admin on Fri Dec 15 15:04:50 UTC 2023
PRIMARY
PUBCHEM
31290
Created by admin on Fri Dec 15 15:04:50 UTC 2023 , Edited by admin on Fri Dec 15 15:04:50 UTC 2023
PRIMARY
EPA CompTox
DTXSID7059563
Created by admin on Fri Dec 15 15:04:50 UTC 2023 , Edited by admin on Fri Dec 15 15:04:50 UTC 2023
PRIMARY
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ACTIVE MOIETY