Consensus flow list

Identity

Type
Neutral molecule
CAS
629-59-4
EC
211-096-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Tetradecane

Alternative labels

9

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string BGHCVCJVXZWKCC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3
IUPAC name chemrof:IUPAC_name Tetradecane
Molecular formula chemrof:molecular_formula C14H30
Molecular mass chemrof:molecular_mass 198.394
Monoisotopic mass chemrof:monoisotopic_mass 198.23475, 198.234751
SMILES string chemrof:smiles_string CCCCCCCCCCCCCC

Known URLs

22

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
beilstein beilstein:1733859 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=629-59-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:41253 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.088 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1027267 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB03563 enrich_references.chebi_xrefs
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=72440 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL135488 enrich_references.pubchem_identifier_url
gmelin gmelin:69263 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/03LY784Y58 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0059907 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.095H enrich_references.pubchem_identifier_url
knapsack knapsack:C00035879 enrich_references.chebi_xrefs
lipidmaps.org https://lipidmaps.org/databases/lmsd/LMFA11000586 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=5281 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:C14 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/12389 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/19660770 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19712193 enrich_references.chebi_xrefs
reaxys reaxys:1733859 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q150808 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Tetradecane enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
172a64d2-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
08a91e70-3ddc-11dd-a028-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
4f77b719-3426-4958-b7ff-009dc1ec2336 Environmental → Air → Indoor EF 3.1 kg 4
08a91e70-3ddc-11dd-a027-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-a029-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
08a91e70-3ddc-11dd-a026-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
172a64d0-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Agricultural EF 3.1 kg 4
172a64d3-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Non-agricultural EF 3.1 kg 4
172a64d5-6556-11dd-ad8b-0800200c9a66 Environmental → Ground → Unknown EF 3.1 kg 4
172a64d7-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Long-term EF 3.1 kg 0
172a64d4-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Ocean EF 3.1 kg 4
172a64d1-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Surface water EF 3.1 kg 4
172a64d6-6556-11dd-ad8b-0800200c9a66 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
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      "@value": "TS Paraffin TS 4",
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