N-octanenitrile

1-Cyanooctane
1-Octyl cyanide
n-Nonanenitrile
n-Nonanonitrile
n-Octyl cyanide
Nonanenitrile
Nonanitrile
Nonanonitrile
Octyl cyanide
Pelargonitrile
Pelargononitrile

Property	Value
InChI2D key string chemrof:inchi2d_key_string	PLZZPPHAMDJOSR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H17N/c1-2-3-4-5-6-7-8-9-10/h2-8H2,1H3
IUPAC name chemrof:IUPAC_name	1-Cyanooctane
Molecular formula chemrof:molecular_formula	C9H17N
Molecular mass chemrof:molecular_mass	139.242
Monoisotopic mass chemrof:monoisotopic_mass	139.1361
SMILES string chemrof:smiles_string	CCCCCCCCC#N

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=2243-27-8	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.017.100	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID6022183	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=5560	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6Q10KP3P20	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J46.553D	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/16715	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27265303	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
2b9103a0-9d6a-4da7-9b9a-75e6fc2af11b	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
0fcde24c-d725-4818-8374-66eac18bc42d	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
f90467a3-51bc-416b-a463-6b785adbb820	Environmental → Air → Indoor	EF 3.1	kg	2
b2a1edbb-e1d4-4a01-846f-880d9a4d0946	Environmental → Air → Long-term	EF 3.1	kg	0
727d210b-41a8-4cb9-9143-4aa5e41f3911	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
1d0cc11a-b011-4eee-b325-a5a51850e33c	Environmental → Air → Unknown	EF 3.1	kg	2
2301321a-4992-4a32-ad74-8b09f66460ac	Environmental → Ground → Agricultural	EF 3.1	kg	2
a956c9cb-4ea4-41fd-bec8-1581ae7adb5f	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
20a3892a-7c66-483d-a608-be289800a679	Environmental → Ground → Unknown	EF 3.1	kg	2
e52ba951-1ae7-4b41-a46f-8e2a657588dd	Environmental → Water → Long-term	EF 3.1	kg	0
06e86ade-9ec5-43c7-99ec-9b079bdcaf2b	Environmental → Water → Ocean	EF 3.1	kg	2
02cbbcc0-c080-4318-b98a-3c93dcecf3fc	Environmental → Water → Surface water	EF 3.1	kg	2
cad131a7-f9a2-4812-b5f5-7c176c45fa23	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (58 changes)

Open the changes page

Flow object JSON

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}

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N-octanenitrile

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