2,4,5-T OLEYLPROPYLENEDIAMMONIUM

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H44N2.C8H5Cl3O3
Molecular Weight	580.07
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2,4,5-T OLEYLPROPYLENEDIAMMONIUM

Structure Search

SMILES

OC(=O)COC1=CC(Cl)=C(Cl)C=C1Cl.CCCCCCCC\C=C/CCCCCCCCNCCCN

InChI

InChIKey=DXADFHMPMWUJBF-KVVVOXFISA-N

InChI=1S/C21H44N2.C8H5Cl3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22;9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h9-10,23H,2-8,11-22H2,1H3;1-2H,3H2,(H,12,13)/b10-9-;

HIDE SMILES / InChI

Molecular Formula	C8H5Cl3O3
Molecular Weight	255.483
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 `Mon Mar 31 22:47:48 GMT 2025` Edited by `admin` on `Mon Mar 31 22:47:48 GMT 2025`
Record UNII	79M5L8WMBT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4,5-T N-OLEYL-1,3-PROPYLENEDIAMINE SALT

Preferred Name

English

2,4,5-T OLEYLPROPYLENEDIAMMONIUM

Common Name

English

ACETIC ACID, (2,4,5-TRICHLOROPHENOXY)-, COMPD. WITH (Z)-N-9-OCTADECENYL-1,3-PROPANEDIAMINE (1:1)

Common Name

English

Code System Code Type Description

CAS

53404-87-8

Created by admin on Mon Mar 31 22:47:48 GMT 2025 , Edited by admin on Mon Mar 31 22:47:48 GMT 2025

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EPA CompTox

DTXSID10896774

Created by admin on Mon Mar 31 22:47:48 GMT 2025 , Edited by admin on Mon Mar 31 22:47:48 GMT 2025

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PUBCHEM

6434461

Created by admin on Mon Mar 31 22:47:48 GMT 2025 , Edited by admin on Mon Mar 31 22:47:48 GMT 2025

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FDA UNII

79M5L8WMBT

Created by admin on Mon Mar 31 22:47:48 GMT 2025 , Edited by admin on Mon Mar 31 22:47:48 GMT 2025

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