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Details

Stereochemistry ACHIRAL
Molecular Formula C19H42N2.C2H4O2
Molecular Weight 358.6021
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-HEXADECYL-1,3-PROPANEDIAMINE MONOACETATE

SMILES

CC(O)=O.CCCCCCCCCCCCCCCCNCCCN

InChI

InChIKey=HIDOYMXNFFDAHC-UHFFFAOYSA-N
InChI=1S/C19H42N2.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20;1-2(3)4/h21H,2-20H2,1H3;1H3,(H,3,4)

HIDE SMILES / InChI

Molecular Formula C19H42N2
Molecular Weight 298.5502
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H4O2
Molecular Weight 60.052
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
YXF13PY56C
Record Status Validated (UNII)
Record Version