Consensus flow list

Identity

Type
Neutral molecule
CAS
108-38-3
EC
203-576-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for M-xylene

Alternative labels

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string IVSZLXZYQVIEFR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3
IUPAC name chemrof:IUPAC_name M-xylene
Molecular formula chemrof:molecular_formula C8H10
Molecular mass chemrof:molecular_mass 106.168
Monoisotopic mass chemrof:monoisotopic_mass 106.07825
SMILES string chemrof:smiles_string Cc1cccc(C)c1

Known URLs

28

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=108-38-3 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/ZE22B6B8.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:28488 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.252 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0085 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6026298 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=61769 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL286727 enrich_references.pubchem_identifier_url
gmelin gmelin:101390 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/O9XS864HTE enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0059810 enrich_references.chebi_xrefs
hts.usitc.gov https://hts.usitc.gov/search?query=2902.42.00.00 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.421J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C07208 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C07208 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=51734 enrich_references.pubchem_identifier_url
MetaCyc https://metacyc.org/compound?orgid=META&id=META-XYLENE enrich_references.chebi_xrefs
pharos.nih.gov https://pharos.nih.gov/ligands/CW9LDBTN1P3R enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/7929 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1307 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/14755610 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22360283 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24389912 enrich_references.chebi_xrefs
reaxys reaxys:605441 enrich_references.chebi_xrefs
umbbd.compound umbbd.compound:c0240 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q3234708 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/M-Xylene enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/M-xylene enrich_references.chebi_xrefs

Elementary flows

15
Flow Context Source Unit CFs
f214ae13-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 5
08a91e70-3ddc-11dd-96fb-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 5
55ca71c0-55d0-4e18-8bd0-7e460f7f54e7 Environmental → Air → Indoor EF 3.1 kg 4
08a91e70-3ddc-11dd-96c2-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 1
08a91e70-3ddc-11dd-96f3-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 5
08a91e70-3ddc-11dd-96c1-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 5
08a91e70-3ddc-11dd-96bf-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
08a91e70-3ddc-11dd-9468-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
08a91e70-3ddc-11dd-96c0-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
08a91e70-3ddc-11dd-9466-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9469-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
4b00efbfb3e6a28e55b29cb74dcd4034ff38c06f Environmental → Water → River bafu algorithm addition kg 0
fe0acd60-3ddc-11dd-9eff-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
50091fecbc712590656bd462f2bc6e7fd499cd3a Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-9467-0050c2490048 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
{
  "flow_object_id": "fo-9e8c6faeaec0f104",
  "prefLabel": [
    {
      "@value": "M-xylene",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
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  ],
  "altLabel": [
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
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      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1,3-Xylene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3-Methyltoluene",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3-xylene",
      "@language": "en",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "Benzene, 1,3-dimethyl-",
      "@language": "en",
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    },
    {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "m-methyltoluene",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
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      "@lang": "en",
      "provenance": {
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    "https://w3id.org/chemrof/IUPAC_name": {
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