Pentachloroethane

1,1,1,2,2-pentachloro-ethane
1,1,1,2,2-pentachloroethane
CCl3CHCl2
CHCl2CCl3
Cl3CCHCl2
ethane pentachloride
Ethane, 1,1,1,2,2-pentachloro-
Ethane, pentachloro-
pentalin

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	BNIXVQGCZULYKV-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C2HCl5/c3-1(4)2(5,6)7/h1H
IUPAC name chemrof:IUPAC_name	Pentachloroethane
Molecular formula chemrof:molecular_formula	C2HCl5
Molecular mass chemrof:molecular_mass	202.295
Monoisotopic mass chemrof:monoisotopic_mass	199.852088, 199.85209
SMILES string chemrof:smiles_string	ClC(Cl)C(Cl)(Cl)Cl

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=76-01-7	enrich_references.chebi_xrefs
cdc.gov	https://www.cdc.gov/niosh-rtecs/KI602160.html	enrich_references.pubchem_identifier_url
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:76287	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.000.842	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1394	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7021104	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL350040	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/QOJ9TH7LDL	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0256247	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.471K	enrich_references.pubchem_identifier_url
KEGG	https://www.genome.jp/entry/C19496	enrich_references.chebi_xrefs
kegg.jp	https://www.kegg.jp/entry/C19496	enrich_references.pubchem_identifier_url
MetaCyc	https://metacyc.org/compound?orgid=META&id=PENTACHLOROETHANE	enrich_references.chebi_xrefs
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/6419	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#1669	enrich_references.pubchem_identifier_url
PubMed	https://pubmed.ncbi.nlm.nih.gov/10476437	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/12778204	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/2576814	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/2916082	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/3473034	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/5171121	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/8637849	enrich_references.chebi_xrefs
reaxys	reaxys:1736845	enrich_references.chebi_xrefs
Wikidata	https://www.wikidata.org/wiki/Q4348652	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Pentachloroethane	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
e2fab6a6-6555-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f64-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
81f93c3e-1d71-46ff-940d-b77571db6578	Environmental → Air → Indoor	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f63-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	0
08a91e70-3ddc-11dd-9f65-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f62-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f60-0050c2490048	Environmental → Ground → Agricultural	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f69-0050c2490048	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f61-0050c2490048	Environmental → Ground → Unknown	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f67-0050c2490048	Environmental → Water → Long-term	EF 3.1	kg	0
08a91e70-3ddc-11dd-9f6a-0050c2490048	Environmental → Water → Ocean	EF 3.1	kg	4
08a91e70-3ddc-11dd-9f66-0050c2490048	Environmental → Water → Surface water	EF 3.1	kg	4
a13aa8d6eaaceaf4c7c705b301dca5cf8f727dd4	Environmental → Water → Unconfined aquifer	stepwise algorithm addition	kg	0
08a91e70-3ddc-11dd-9f68-0050c2490048	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (57 changes)

Open the changes page

Flow object JSON

{
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You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Pentachloroethane

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

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