Consensus flow list

Identity

Type
Neutral molecule
CAS
7149-79-3
EC
230-483-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for N-(3-chloro-4-methylphenyl)acetamide

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string IGLVCWPPISIXPR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H10ClNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12)
IUPAC name chemrof:IUPAC_name N-(3-chloro-4-methylphenyl)acetamide
Molecular formula chemrof:molecular_formula C9H10ClNO
Molecular mass chemrof:molecular_mass 183.638
Monoisotopic mass chemrof:monoisotopic_mass 183.045092
SMILES string chemrof:smiles_string CC(=O)Nc1ccc(C)c(Cl)c1

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=7149-79-3 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.027.712 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8042181 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=72333 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186889 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/X7X7S72D5R enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J14.773G enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/23537 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27293653 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
5fee1fcd-cbcb-4df6-ae1c-a773de38a9ff Environmental → Air → Aircraft cruise height EF 3.1 kg 2
1d1af8fd-71b6-4c30-b219-8858f82cc200 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
466542a0-c0f6-400d-bdb0-b582bfd82e14 Environmental → Air → Indoor EF 3.1 kg 2
975a5a86-9574-4c8c-a123-ad39ff3ab0bc Environmental → Air → Long-term EF 3.1 kg 0
2c2a7ec0-e8a4-4225-8a20-8dde237ba2a9 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
f9fd9584-db48-461f-b629-89166fe750ed Environmental → Air → Unknown EF 3.1 kg 2
85e43fd8-915b-4073-844a-d82b876fbeb6 Environmental → Ground → Agricultural EF 3.1 kg 2
53bfb7e8-41e7-4504-9667-669a7644a469 Environmental → Ground → Non-agricultural EF 3.1 kg 2
43ee41f4-f85d-48f9-b254-ca24bd7ffffd Environmental → Ground → Unknown EF 3.1 kg 2
d958bcbf-f306-4e86-99eb-a86a59e26fa8 Environmental → Water → Long-term EF 3.1 kg 0
d9aef7e7-9c5b-41e0-aae2-86cb6b2067c1 Environmental → Water → Ocean EF 3.1 kg 2
100e04d8-65fa-40f4-a28e-bc42104fc5e1 Environmental → Water → Surface water EF 3.1 kg 2
7536e2ac-52ce-4be7-8713-3958aafdc834 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-ce18350348dbe4ad",
  "prefLabel": [
    {
      "@value": "N-(3-chloro-4-methylphenyl)acetamide",
      "@language": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "3′-Chloro-4′-acetotoluidide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3′-Chloro-4′-methylacetanilide",
      "@language": "en",
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    {
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      }
    },
    {
      "@value": "Acetamide, N-(3-chloro-4-methylphenyl)-",
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