Pentachloroaniline

2,3,4,5,6-Pentachloroaniline
2,3,4,5,6-Pentachlorobenzenamine
Aniline, 2,3,4,5,6-pentachloro-
Aniline, pentachloro-
Benzenamine, 2,3,4,5,6-pentachloro-
Pentachloroaminobenzene

Property	Value
InChI2D key string chemrof:inchi2d_key_string	KHCZSJXTDDHLGJ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C6H2Cl5N/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H2
IUPAC name chemrof:IUPAC_name	Pentachloroaniline
Molecular formula chemrof:molecular_formula	C6H2Cl5N
Molecular mass chemrof:molecular_mass	265.354
Monoisotopic mass chemrof:monoisotopic_mass	262.862987
SMILES string chemrof:smiles_string	Nc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl

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=527-20-8	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.007.647	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID4037584	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=49579	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1904605	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/UW5QVL647I	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.583K	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/10693	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27291304	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Pentachloroaniline	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
1e1cf4f5-c995-41e6-b05d-161dfc0ac2ab	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
b438e7ea-c85f-418a-b3a2-39aa3e5dc323	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
7663fb3d-2934-4551-888a-2f45b02a23cf	Environmental → Air → Indoor	EF 3.1	kg	2
1e6b303a-01c0-4257-9164-7a757fd235d9	Environmental → Air → Long-term	EF 3.1	kg	0
3164c9c9-1b6c-4867-9262-bd967336d365	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
1c018c77-a5f2-43d9-a9da-d37c515e9aaa	Environmental → Air → Unknown	EF 3.1	kg	2
971c4eed-6c4b-4fd6-9cfd-cd07630c1af8	Environmental → Ground → Agricultural	EF 3.1	kg	2
123c0fd0-5341-4103-b979-fe3d98591765	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
a7070128-f54c-4bd4-b30a-32b916e6c65f	Environmental → Ground → Unknown	EF 3.1	kg	2
89586af2-5a63-4ec1-87a4-1a6bb98b2066	Environmental → Water → Long-term	EF 3.1	kg	0
1f24203d-9588-4247-8f37-743196e321a2	Environmental → Water → Ocean	EF 3.1	kg	2
f9b6e031-967c-4f3c-b84a-28fa066202f6	Environmental → Water → Surface water	EF 3.1	kg	2
7ab13a85-2a96-410a-9eb1-b9b8ab68e764	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

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Flow object JSON

{
  "flow_object_id": "fo-b8bdf495384c789f",
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    {
      "@value": "Pentachloroaniline",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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}

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Pentachloroaniline

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Structure

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