N-OLEYL-1,3-PROPANEDIAMINE DIACETATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H44N2.2C2H4O2
Molecular Weight	444.6914
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of N-OLEYL-1,3-PROPANEDIAMINE DIACETATE

Structure Search

SMILES

CC(O)=O.CC(O)=O.CCCCCCCC\C=C/CCCCCCCCNCCCN

InChI

InChIKey=RYWKPLKIXPVEKP-XXAVUKJNSA-N

InChI=1S/C21H44N2.2C2H4O2/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/h9-10,23H,2-8,11-22H2,1H3;2*1H3,(H,3,4)/b10-9-;;

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	C21H44N2
Molecular Weight	324.5875
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:06:14 GMT 2023` Edited by `admin` on `Sat Dec 16 10:06:14 GMT 2023`
Record UNII	VR297B9F58
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-OLEYL-1,3-PROPANEDIAMINE DIACETATE

Systematic Name

English

3-AZANIUMYLPROPYL(OCTADEC-9-ENYL)AZANIUM, DIACETATE

Systematic Name

English

1,3-PROPANEDIAMINE, N1-(9Z)-9-OCTADECEN-1-YL-, ACETATE (1:2)

Systematic Name

English

(Z)-1-(OCTADEC-9-ENYLAMMONIO)PROPANE-3-AMMONIUM DIACETATE

Systematic Name

English

(Z)-N1-(OCTADEC-9-EN-1-YL)PROPANE-1,3-DIAMINE DIACETATE

Systematic Name

English

1,3-PROPANEDIAMINE, N-9-OCTADECENYL-, (Z)-, DIACETATE

Systematic Name

English

1,3-PROPANEDIAMINE, N-(9Z)-9-OCTADECENYL-, DIACETATE

Systematic Name

English

N-OLEYLTRIMETHYLENEDIAMINE, DIACETATE

Systematic Name

English

J231.553J

Code

English

DUOMAC O

Brand Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

67327