Consensus flow list

1,1,1,2,3-pentachlorpropane

fo-72d771fda25d7de9

Identity

Type
NeutralMolecule
CAS
21700-31-2
EC
688-501-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for 1,1,1,2,3-pentachlorpropane

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string ZXPCCXXSNUIVNK-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H3Cl5/c4-1-2(5)3(6,7)8/h2H,1H2
IUPAC name chemrof:IUPAC_name 1,1,1,2,3-Pentachloropropane
Molecular formula chemrof:molecular_formula C3H3Cl5
Molecular mass chemrof:molecular_mass 216.322
Monoisotopic mass chemrof:monoisotopic_mass 213.867738
SMILES string chemrof:smiles_string ClCC(Cl)C(Cl)(Cl)Cl

Known URLs

6

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=21700-31-2 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.215.178 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID60541282 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J88.020E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/13454491 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q82417610 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
2e61c439-37ff-4874-b0f9-d00039e5a77e Environmental → Air → Aircraft cruise height EF 3.1 kg 2
ad49d345-44a9-4f4e-8eb0-9c02089b264a Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
74bf4573-2ec9-41ac-b047-56610a328a02 Environmental → Air → Indoor EF 3.1 kg 2
3158f628-0ab2-4c25-88f5-c0b4b036c4ae Environmental → Air → Long-term EF 3.1 kg 0
5e986ea0-56ad-4acf-ab3b-552446d8a86d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
0782cad1-7e8d-4d81-9818-821d29f46d82 Environmental → Air → Unknown EF 3.1 kg 2
cc82676f-4d9b-443d-a6fb-a32c558337bc Environmental → Ground → Agricultural EF 3.1 kg 2
2b616032-3cdf-4170-8507-cc7828aa5e70 Environmental → Ground → Non-agricultural EF 3.1 kg 2
316e73df-2630-43d0-97da-41c70616d7a4 Environmental → Ground → Unknown EF 3.1 kg 2
4dd20564-ef05-4a90-8820-d4f728c6c247 Environmental → Water → Long-term EF 3.1 kg 0
81e703de-109a-45ab-a90f-f44831d6a311 Environmental → Water → Ocean EF 3.1 kg 2
6e46c43f-6664-4178-b19d-5a6e480d4b19 Environmental → Water → Surface water EF 3.1 kg 2
7c10b676-d013-4590-9c7c-65382ace2f71 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-72d771fda25d7de9",
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    },
    {
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}

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