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8,9,10,11-tetrachloro-12h-isoindolo[2,1-a]perimidin-12-one

fo-75750ef586918c92

Identity

Type
Neutral molecule
CAS
20749-68-2
EC
244-007-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 8,9,10,11-tetrachloro-12h-isoindolo[2,1-a]perimidin-12-one

Alternative labels

19

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string UBZVRROHBDDCQY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C18H6Cl4N2O/c19-13-11-12(14(20)16(22)15(13)21)18(25)24-9-6-2-4-7-3-1-5-8(10(7)9)23-17(11)24/h1-6H
IUPAC name chemrof:IUPAC_name 8,9,10,11-tetrachloro-12h-isoindolo[2,1-a]perimidin-12-one
Molecular formula chemrof:molecular_formula C18H6Cl4N2O
Molecular mass chemrof:molecular_mass 408.071
Monoisotopic mass chemrof:monoisotopic_mass 405.923424
SMILES string chemrof:smiles_string O=C1c2c(Cl)c(Cl)c(Cl)c(Cl)c2C2=Nc3cccc4cccc(c34)N12

Known URLs

9

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=20749-68-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.039.992 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.121.441 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6041260 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/50TEX4842R enrich_references.pubchem_identifier_url
hts.usitc.gov https://hts.usitc.gov/search?query=3204.19.25.20 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J225.324K enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/88680 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27260817 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e8f6fce4-6cc6-48fe-929c-8eb824e1d448 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
6e1652f9-17b9-471d-85a4-3d85e4ca0c49 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
001121e5-c42c-4971-8e83-f5599a24d145 Environmental → Air → Indoor EF 3.1 kg 4
0611b3fa-b473-4181-8cc8-7090011d1c50 Environmental → Air → Long-term EF 3.1 kg 0
b7ae097d-65d5-4c69-9d54-ea73a9b1b91d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
fd50509d-f8c0-476c-a133-c5c8a2de1944 Environmental → Air → Unknown EF 3.1 kg 4
8c14f64c-5a8d-44ff-a788-6151875a25f3 Environmental → Ground → Agricultural EF 3.1 kg 4
d3051db2-3073-4277-9682-2728017775fe Environmental → Ground → Non-agricultural EF 3.1 kg 4
16182e22-9322-4a84-8914-20471e895c9c Environmental → Ground → Unknown EF 3.1 kg 4
ca523b7f-f378-4859-9377-a4bff815d07a Environmental → Water → Long-term EF 3.1 kg 0
f39fa340-4fcf-496a-894a-861f5eccc828 Environmental → Water → Ocean EF 3.1 kg 4
04b6c4ca-37d5-42bf-9248-2a80484c5518 Environmental → Water → Surface water EF 3.1 kg 4
38206e41-82dc-4fd8-b4f5-724c6527e9e2 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
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}

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