3-(OCTYLAMINO)PROPIONONITRILE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H22N2
Molecular Weight	182.3058
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(OCTYLAMINO)PROPIONONITRILE

Structure Search

SMILES

CCCCCCCCNCCC#N

InChI

InChIKey=AFXXFNVAHYRPIZ-UHFFFAOYSA-N

InChI=1S/C11H22N2/c1-2-3-4-5-6-7-10-13-11-8-9-12/h13H,2-8,10-11H2,1H3

HIDE SMILES / InChI

Molecular Formula	C11H22N2
Molecular Weight	182.3058
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 `Tue Apr 01 20:37:28 GMT 2025` Edited by `admin` on `Tue Apr 01 20:37:28 GMT 2025`
Record UNII	6UF63IQW5X
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-(OCTYLAMINO)PROPIONONITRILE

Systematic Name

English

N-(2-CYANOETHYL)OCTYLAMINE

Preferred Name

English

PROPANENITRILE, 3-(OCTYLAMINO)-

Systematic Name

English

Code System Code Type Description

CAS

29504-89-0

Created by admin on Tue Apr 01 20:37:28 GMT 2025 , Edited by admin on Tue Apr 01 20:37:28 GMT 2025

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EPA CompTox

DTXSID80183704

Created by admin on Tue Apr 01 20:37:28 GMT 2025 , Edited by admin on Tue Apr 01 20:37:28 GMT 2025

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PUBCHEM

122399

Created by admin on Tue Apr 01 20:37:28 GMT 2025 , Edited by admin on Tue Apr 01 20:37:28 GMT 2025

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ECHA (EC/EINECS)

249-669-2

Created by admin on Tue Apr 01 20:37:28 GMT 2025 , Edited by admin on Tue Apr 01 20:37:28 GMT 2025

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FDA UNII

6UF63IQW5X

Created by admin on Tue Apr 01 20:37:28 GMT 2025 , Edited by admin on Tue Apr 01 20:37:28 GMT 2025

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