Consensus flow list

1,4-dichlorobutane

fo-cf123a5927a7d2d2

Identity

Type
NeutralMolecule
CAS
110-56-5
EC
203-778-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 1,4-dichlorobutane

Alternative labels

2

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string KJDRSWPQXHESDQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H8Cl2/c5-3-1-2-4-6/h1-4H2
IUPAC name chemrof:IUPAC_name 1,4-dichlorobutane
Molecular formula chemrof:molecular_formula C4H8Cl2
Molecular mass chemrof:molecular_mass 127.014
Monoisotopic mass chemrof:monoisotopic_mass 126.000306
SMILES string chemrof:smiles_string ClCCCCCl

Known URLs

10

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=110-56-5 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.436 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5021918 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=6288 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8326YNM2B3 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.094F enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8059 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1993 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q161526 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/1,4-Dichlorobutane enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
db251aac-5780-4386-8e61-e445acecee09 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
d6259f49-5573-4cff-b942-a7688b4c8682 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
16be5b20-3e8c-4f05-9a36-30bda23335a3 Environmental → Air → Indoor EF 3.1 kg 2
5dbe851b-64f5-4aea-a9ac-5d4eacfd57b4 Environmental → Air → Long-term EF 3.1 kg 0
83378a44-3ef5-41f3-89b9-073fcb227572 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
45fe48db-bcdf-4da0-bc13-8bbb8ac773a6 Environmental → Air → Unknown EF 3.1 kg 2
41826bee-124f-4a96-b9d8-5e63c8bb3a9a Environmental → Ground → Agricultural EF 3.1 kg 2
e2ac0993-a414-4d35-aa11-3f4201d5c6a6 Environmental → Ground → Non-agricultural EF 3.1 kg 2
aa8d117d-b94a-4269-9ff3-44a6fb7703bf Environmental → Ground → Unknown EF 3.1 kg 2
bf0628a7-8568-4ce7-9ceb-80913f131cb5 Environmental → Water → Long-term EF 3.1 kg 0
ab466d0d-1e80-4043-804b-f8f9a1f77b06 Environmental → Water → Ocean EF 3.1 kg 2
bf0799fe-dc57-42e5-9986-5f832256a5df Environmental → Water → Surface water EF 3.1 kg 2
7fae92df-1b08-41b2-b5a1-4d03a8d6af5e Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-cf123a5927a7d2d2",
  "prefLabel": [
    {
      "@value": "1,4-dichlorobutane",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
    {
      "@value": "4-Chlorobutyl chloride",
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    },
    {
      "@value": "Butane, 1,4-dichloro-",
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    "https://w3id.org/chemrof/monoisotopic_mass": {
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  },
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}

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