1,3-bis(trifluoromethyl)benzene

1,3-Di(trifluoromethyl)benzene
3,5-Bis(trifluoromethyl)benzene
3-(Trifluoromethyl)benzotrifluoride
Benzene, 1,3-bis(trifluoromethyl)-
m-(Trifluoromethyl)benzotrifluoride
m-Bis(trifluoromethyl)benzene
m-Xylene, α,α,α,α′,α′,α′-hexafluoro-
α,α,α,α′,α′,α′-Hexafluoro-m-xylene

Property	Value
InChI2D key string chemrof:inchi2d_key_string	SJBBXFLOLUTGCW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C8H4F6/c9-7(10,11)5-2-1-3-6(4-5)8(12,13)14/h1-4H
IUPAC name chemrof:IUPAC_name	1,3-bis(trifluoromethyl)benzene
Molecular formula chemrof:molecular_formula	C8H4F6
Molecular mass chemrof:molecular_mass	214.108
Monoisotopic mass chemrof:monoisotopic_mass	214.021719
SMILES string chemrof:smiles_string	FC(F)(F)c1cccc(C(F)(F)F)c1

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=402-31-3	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.006.310	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID1059949	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=10342	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/F7TWF66P6X	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J37.675B	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/223106	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q72447152	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/1,3-Bis(trifluoromethyl)benzene	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
428f6d0d-6edd-4c78-9939-0f5b5f1fcf95	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
28bab327-6b97-438e-8d8e-ef0be57ee252	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
659c9635-da9e-4631-9111-650c087862a2	Environmental → Air → Indoor	EF 3.1	kg	2
a76a06f7-68d3-4cf9-bad9-85475c684bf9	Environmental → Air → Long-term	EF 3.1	kg	0
1a566b56-5bad-470c-ad49-d3f369d25163	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
d1ea8174-724d-4e30-80f6-e4be81e8f621	Environmental → Air → Unknown	EF 3.1	kg	2
fe58264b-afd8-4f05-b737-c5a1a1fef5d2	Environmental → Ground → Agricultural	EF 3.1	kg	2
d7e30eb6-1bb9-4a8f-8112-8243c8071222	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
72bb8fe9-6d72-4a4f-87d2-86130386ae40	Environmental → Ground → Unknown	EF 3.1	kg	2
298bbbf5-ad22-4d59-ae80-00d6d9b56529	Environmental → Water → Long-term	EF 3.1	kg	0
18724511-bf09-4b65-97d9-e543603895ce	Environmental → Water → Ocean	EF 3.1	kg	2
aa73f496-5bfd-4aa1-993a-5ee5dfbc338c	Environmental → Water → Surface water	EF 3.1	kg	2
9df3ab39-cd00-4821-b1c1-e76c7e7a1323	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

{
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}

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1,3-bis(trifluoromethyl)benzene

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