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Details

Stereochemistry ACHIRAL
Molecular Formula C29H62N.Cl
Molecular Weight 460.262
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYLOCTYLDIDECYLAMMONIUM CHLORIDE

SMILES

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

InChI

InChIKey=QKAZXRQKJUMPMJ-UHFFFAOYSA-M
InChI=1S/C29H62N.ClH/c1-5-8-11-14-17-19-22-25-28-30(4,27-24-21-16-13-10-7-3)29-26-23-20-18-15-12-9-6-2;/h5-29H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C29H62N
Molecular Weight 424.8093
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 18:35:04 GMT 2023
Edited
by admin
on Sat Dec 16 18:35:04 GMT 2023
Record UNII
RC52X2YJ3T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYLOCTYLDIDECYLAMMONIUM CHLORIDE
Systematic Name English
1-DECANAMINIUM, N-DECYL-N-METHYL-N-OCTYL-, CHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
RC52X2YJ3T
Created by admin on Sat Dec 16 18:35:04 GMT 2023 , Edited by admin on Sat Dec 16 18:35:04 GMT 2023
PRIMARY
CAS
77502-70-6
Created by admin on Sat Dec 16 18:35:04 GMT 2023 , Edited by admin on Sat Dec 16 18:35:04 GMT 2023
PRIMARY
PUBCHEM
18398484
Created by admin on Sat Dec 16 18:35:04 GMT 2023 , Edited by admin on Sat Dec 16 18:35:04 GMT 2023
PRIMARY
Related Record Type Details
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