Consensus flow list

Identity

Type
Neutral molecule
CAS
93-69-6
EC
202-268-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for N-(2-methylphenyl)imidodicarbonimidic Diamide

Alternative labels

18

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string SQZCAOHYQSOZCE-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H13N5/c1-6-4-2-3-5-7(6)13-9(12)14-8(10)11/h2-5H,1H3,(H6,10,11,12,13,14)
IUPAC name chemrof:IUPAC_name N-(2-methylphenyl)imidodicarbonimidic Diamide
Molecular formula chemrof:molecular_formula C9H13N5
Molecular mass chemrof:molecular_mass 191.238
Monoisotopic mass chemrof:monoisotopic_mass 191.117095
SMILES string chemrof:smiles_string Cc1ccccc1NC(=N)NC(=N)N

Known URLs

11

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=93-69-6 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.002.063 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3042051 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=164906 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=51980 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3183356 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/5T9Z06LCV4 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J64.492G enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C77543 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7155 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27262844 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
106348b4-9f1c-4c22-bd6e-20523d2a0a41 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
95c46834-534a-4e84-a1ca-e451f936f704 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
55f01da6-1fe8-49f4-b105-9a6e10f4fe1a Environmental → Air → Indoor EF 3.1 kg 2
6bda0d5e-fb4b-4018-ae80-f358184c478d Environmental → Air → Long-term EF 3.1 kg 0
1bf144c2-f901-4232-8ffb-1bbe267f58e0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
05e1b4a5-d522-4ecd-b4ca-66ae25afbd8f Environmental → Air → Unknown EF 3.1 kg 2
716e02c9-5a8a-4ab5-a95d-255aeaa60f57 Environmental → Ground → Agricultural EF 3.1 kg 2
751aa0e9-0f0e-4395-91bd-78228f6939fb Environmental → Ground → Non-agricultural EF 3.1 kg 2
bf9c647e-6d47-4828-ad4f-a13f21b3b70b Environmental → Ground → Unknown EF 3.1 kg 2
2b22e4f9-cf8e-40e5-a40b-fab8c6ff2dc0 Environmental → Water → Long-term EF 3.1 kg 0
99ec3586-e10b-4f89-bfd7-1468886f0385 Environmental → Water → Ocean EF 3.1 kg 2
517908d4-d348-418d-8069-80b8c47f0064 Environmental → Water → Surface water EF 3.1 kg 2
ec005460-2f0e-4001-bf4b-5d7dd0e157ad 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-e88d9c30eb58e220",
  "prefLabel": [
    {
      "@value": "N-(2-methylphenyl)imidodicarbonimidic Diamide",
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        "prov:wasDerivedFrom": "legacy name field"
      }
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  ],
  "altLabel": [
    {
      "@value": "1-(2-Methylphenyl)biguanide",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "1-(Diaminomethylidene)-2-(2-methylphenyl)guanidine",
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      }
    },
    {
      "@value": "1-Carbamimidamido-N-(2-methylphenyl)methanimidamide",
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    },
    {
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    },
    {
      "@value": "Accelerator BG",
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      "@value": "Biguanide, 1-o-tolyl-",
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      "@value": "Eponoc B",
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    },
    {
      "@value": "Proventine 17",
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    },
    {
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  "properties": {
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