2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanenitrile

2-Cyano-1,1,1,2,3,3,3-heptafluoropropane
Heptafluoroisobutyronitrile
Perfluoroisobutyronitrile
Propanenitrile, 2,3,3,3-tetrafluoro-2-(trifluoromethyl)-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	AASDJASZOZGYMM-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C4F7N/c5-2(1-12,3(6,7)8)4(9,10)11
IUPAC name chemrof:IUPAC_name	2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanenitrile
Molecular formula chemrof:molecular_formula	C4F7N
Molecular mass chemrof:molecular_mass	195.037
Monoisotopic mass chemrof:monoisotopic_mass	194.991897
SMILES string chemrof:smiles_string	N#CC(F)(C(F)(F)F)C(F)(F)F

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=42532-60-5	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.233.498	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID90505110	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.610.425B	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/12633773	enrich_references.pubchem_compound
wikidata.org	https://www.wikidata.org/wiki/Q82360007	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
3368b1f5-cd81-46f5-a84d-16d738bcf005	Environmental → Air → Aircraft cruise height	EF 3.1	kg	6
2b7beae1-cd8c-4355-ac80-00dd61c48098	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	6
fda41603-41df-4140-b343-8deee1ca77a1	Environmental → Air → Indoor	EF 3.1	kg	6
9d52e13d-6358-402b-ae50-c6ee6c79ffb5	Environmental → Air → Long-term	EF 3.1	kg	2
45780d4a-a722-4c43-97ce-a7a8cccbba3a	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	6
a965bb86-79fb-4c3e-8d82-f9bdd815c406	Environmental → Air → Unknown	EF 3.1	kg	6
b5349c28-32f8-42a2-b979-b21a33bb82d3	Environmental → Ground → Agricultural	EF 3.1	kg	4
c9417e67-0531-4fd7-bac7-89c5c1796795	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
209922df-559e-47c7-a82e-a1ad46a084a3	Environmental → Ground → Unknown	EF 3.1	kg	4
60f321ac-5b00-4313-99d5-b2f99415958e	Environmental → Water → Long-term	EF 3.1	kg	0
617afdda-17ed-4b92-98d3-e23186cfb824	Environmental → Water → Ocean	EF 3.1	kg	4
9ac49b28-9ee6-4361-a5df-ab036049af80	Environmental → Water → Surface water	EF 3.1	kg	4
6c14fab5-19db-42c8-bfc6-496469614f7b	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (54 changes)

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Flow object JSON

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2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanenitrile

Identity

Structure

Alternative labels

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Known URLs

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