OCTANENITRILE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H15N
Molecular Weight	125.2114
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CCCCCCCC#N

InChI

InChIKey=YSIMAPNUZAVQER-UHFFFAOYSA-N

InChI=1S/C8H15N/c1-2-3-4-5-6-7-8-9/h2-7H2,1H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

Show entries

Title	Date	PubMed
Partition coefficients of alkyl aromatic hydrocarbons and esters in a hexane-acetonitrile system.	2001 Jul 20	11510535
GC identification of organic compounds based on partition coefficients of their TMS derivatives in a hexane-acetonitrile system and retention indices.	2005 Dec	16379391
Model for the distribution of neutral organic compounds between n-hexane and acetonitrile.	2006 Feb 3	16337209
Determination of descriptors for organosilicon compounds by gas chromatography and non-aqueous liquid-liquid partitioning.	2007 Oct 26	17888932
A partially substituted calix[4]resorcarene receptor and its selective recognition for soft metal cations (silver and mercury).	2008 Feb 21	18220386

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Name

Type

Language

NSC-5513

Preferred Name

English

OCTANENITRILE

Systematic Name

English

HEPTYL CYANIDE

Systematic Name

English

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Code System

Code

Type

Description

ECHA (EC/EINECS)

204-682-2

PRIMARY

CAS

124-12-9

PRIMARY

EPA CompTox

DTXSID1047655

PRIMARY

NSC

5513

PRIMARY

FDA UNII

D6646V87PY

PRIMARY

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SUBSTANCE RECORD


					D6646V87PY

OCTANENITRILE