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Details

Stereochemistry ACHIRAL
Molecular Formula C27H58N.Cl
Molecular Weight 432.209
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYLDIOCTYLDECYLAMMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC

InChI

InChIKey=IPBJXJKKLDVXPC-UHFFFAOYSA-M
InChI=1S/C27H58N.ClH/c1-5-8-11-14-17-18-21-24-27-28(4,25-22-19-15-12-9-6-2)26-23-20-16-13-10-7-3;/h5-27H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C27H58N
Molecular Weight 396.7561
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Cl
Molecular Weight 35.453
Charge -1
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 18:54:37 GMT 2023
Edited
by admin
on Sat Dec 16 18:54:37 GMT 2023
Record UNII
9A4R2VE4LE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYLDIOCTYLDECYLAMMONIUM CHLORIDE
Systematic Name English
1-DECANAMINIUM, N-METHYL-N-DIOCTYL-, CHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
77502-69-3
Created by admin on Sat Dec 16 18:54:37 GMT 2023 , Edited by admin on Sat Dec 16 18:54:37 GMT 2023
PRIMARY
PUBCHEM
18398477
Created by admin on Sat Dec 16 18:54:37 GMT 2023 , Edited by admin on Sat Dec 16 18:54:37 GMT 2023
PRIMARY
FDA UNII
9A4R2VE4LE
Created by admin on Sat Dec 16 18:54:37 GMT 2023 , Edited by admin on Sat Dec 16 18:54:37 GMT 2023
PRIMARY
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