Consensus flow list

Identity

Type
NeutralMolecule
CAS
3173-72-6
EC
221-641-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 1,5-Naphthalene diisocyanate

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string SBJCUZQNHOLYMD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H6N2O2/c15-7-13-11-5-1-3-9-10(11)4-2-6-12(9)14-8-16/h1-6H
IUPAC name chemrof:IUPAC_name 1,5-diisocyanatonaphthalene
Molecular formula chemrof:molecular_formula C12H6N2O2
Molecular mass chemrof:molecular_mass 210.192
Monoisotopic mass chemrof:monoisotopic_mass 210.042927, 210.04293
SMILES string chemrof:smiles_string O=C=Nc1cccc2c(N=C=O)cccc12

Known URLs

16

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=25551-28-4 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=3173-72-6 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/NQ927C00.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82496 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.019.675 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0653 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8040145 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=240728 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0ORB22ST7M enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0244232 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J41.091H enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19464 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19464 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/18503 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2206 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q2786152 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
0a364a16-c76f-432d-a64a-1f79129d72d8 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
093fff79-0df9-4b07-ab83-8aed567d645c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
15355964-6ca1-49a6-9538-f044f7dc320b Environmental → Air → Indoor EF 3.1 kg 4
11e3039e-d751-4f45-89f9-9bf01d4f6ae8 Environmental → Air → Long-term EF 3.1 kg 0
d1553869-4cff-4c78-bba1-044f6cfdd4c2 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
5778145c-3b73-4b0b-ad15-7ddc4112d932 Environmental → Air → Unknown EF 3.1 kg 4
af8d1729-9480-4084-8863-a70a4e55247e Environmental → Ground → Agricultural EF 3.1 kg 4
5c2a8dc0-c0cf-403a-b3c7-a23c096d4620 Environmental → Ground → Non-agricultural EF 3.1 kg 4
101cf7bb-7d9b-4cc4-a56b-8ad6828ed26f Environmental → Ground → Unknown EF 3.1 kg 4
3f46be46-5e1d-47dd-acf4-d7cb47b914f2 Environmental → Water → Long-term EF 3.1 kg 0
19552b10-2dd7-4aad-ba24-a6ec0203a0ac Environmental → Water → Ocean EF 3.1 kg 4
fb2380d2-3d2f-4142-8594-09b3b9372e2b Environmental → Water → Surface water EF 3.1 kg 4
28f1c95f-b677-42ca-9b27-db07a1a345a8 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
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      }
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  ],
  "altLabel": [
    {
      "@value": "1,5-diisocyanatonaphthalene",
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        "prov:wasDerivedFrom": "original name retained as altLabel"
      }
    },
    {
      "@value": "1,5-Naphthalenediol, diisocyanate",
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      "@lang": "en",
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    },
    {
      "@value": "1,5-Naphthyl diisocyanate",
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    {
      "@value": "1,5-Naphthylene diisocyanate",
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    },
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      "@value": "Naphthalene-1,5-diyl diisocyanate",
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