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Details

Stereochemistry ACHIRAL
Molecular Formula C21H46N2.2C2H4O2
Molecular Weight 446.7073
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-OCTADECYL-1,3-PROPANEDIAMINE DIACETATE

SMILES

CC(O)=O.CC(O)=O.CCCCCCCCCCCCCCCCCCNCCCN

InChI

InChIKey=PWCCRLNTCXEDPR-UHFFFAOYSA-N
InChI=1S/C21H46N2.2C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22;2*1-2(3)4/h23H,2-22H2,1H3;2*1H3,(H,3,4)

HIDE SMILES / InChI

Molecular Formula C2H4O2
Molecular Weight 60.052
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H46N2
Molecular Weight 326.6033
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 18:54:42 GMT 2023
Edited
by admin
on Sat Dec 16 18:54:42 GMT 2023
Record UNII
5O9MGR3C4E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-OCTADECYL-1,3-PROPANEDIAMINE DIACETATE
Systematic Name English
1,3-PROPANEDIAMINE, N1-OCTADECYL-, ACETATE (1:2)
Systematic Name English
N-STEARYL-1,3-PROPANEDIAMINE DIACETATE
Systematic Name English
N1-OCTADECYLPROPANE-1,3-DIAMINE DIACETATE
Systematic Name English
1,3-PROPANEDIAMINE, N-OCTADECYL-, DIACETATE
Systematic Name English
Code System Code Type Description
CAS
63129-74-8
Created by admin on Sat Dec 16 18:54:42 GMT 2023 , Edited by admin on Sat Dec 16 18:54:42 GMT 2023
PRIMARY
CAS
96495-14-6
Created by admin on Sat Dec 16 18:54:42 GMT 2023 , Edited by admin on Sat Dec 16 18:54:42 GMT 2023
NON-SPECIFIC STOICHIOMETRY
PUBCHEM
85893269
Created by admin on Sat Dec 16 18:54:42 GMT 2023 , Edited by admin on Sat Dec 16 18:54:42 GMT 2023
PRIMARY
FDA UNII
5O9MGR3C4E
Created by admin on Sat Dec 16 18:54:42 GMT 2023 , Edited by admin on Sat Dec 16 18:54:42 GMT 2023
PRIMARY
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