Dodecylbenzene

1-Dodecylbenzene
1-Phenyl-n-dodecane
1-Phenyldodecane
Alkylate P 1
Benzene, dodecyl-
Detergent Alkylate No. 2
Dodecane, 1-phenyl-
Laurylbenzene
n-Dodecylbenzene

Property	Value
InChI2D key string chemrof:inchi2d_key_string	KWKXNDCHNDYVRT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C18H30/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18/h11,13-14,16-17H,2-10,12,15H2,1H3
IUPAC name chemrof:IUPAC_name	Dodecylbenzene
Molecular formula chemrof:molecular_formula	C18H30
Molecular mass chemrof:molecular_mass	246.438
Monoisotopic mass chemrof:monoisotopic_mass	246.234751
SMILES string chemrof:smiles_string	CCCCCCCCCCCCc1ccccc1

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=123-01-3	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.004.175	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0265	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID7026994	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=102805	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=4584	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3187866	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/A2AX003680	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0251572	enrich_references.pubchem_identifier_url
hts.usitc.gov	https://hts.usitc.gov/search?query=2902.90.30.10	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.538G	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=130685	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/31237	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q414469	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Dodecylbenzene	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
4e57644b-c068-41a0-b435-1f8280fd8cfe	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
b9202f98-a3ba-40be-83d5-50a73f66c0ca	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
7a8d37b7-cc28-46df-8c4f-5fc882d822c3	Environmental → Air → Indoor	EF 3.1	kg	2
1f1415e8-aacf-4f25-8c57-0354558d464d	Environmental → Air → Long-term	EF 3.1	kg	0
8df9f61c-0e18-4e7c-8df4-7fd938f2ac89	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
bccee682-b6e4-4e28-b87d-bd59d36d6dc2	Environmental → Air → Unknown	EF 3.1	kg	2
2f1ae6bf-d6db-403e-8897-3eb74afa2c77	Environmental → Ground → Agricultural	EF 3.1	kg	2
905af361-9d3f-49ed-8c8b-4c3840f34071	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
56421c4e-b035-4907-9877-ee0e5eebe108	Environmental → Ground → Unknown	EF 3.1	kg	2
38d91e9a-e80c-4d1b-9506-af243d705862	Environmental → Water → Long-term	EF 3.1	kg	0
1fb7b147-cd8a-4015-a58a-be170179fd81	Environmental → Water → Ocean	EF 3.1	kg	2
1d8743e3-820f-4b0c-b353-a71033301732	Environmental → Water → Surface water	EF 3.1	kg	2
a9025995-f418-4a85-9c1d-e6a61054f0fa	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (56 changes)

Open the changes page

Flow object JSON

{
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        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "123-01-3"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=123-01-3"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=123-01-3"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "204-591-8"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=204-591-8"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

Dodecylbenzene

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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