Consensus flow list

Identity

Type
NeutralMolecule
CAS
1189-08-8
EC
214-711-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for 1,3-Butyleneglycol dimethacrylate

Alternative labels

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string VDYWHVQKENANGY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H18O4/c1-8(2)11(13)15-7-6-10(5)16-12(14)9(3)4/h10H,1,3,6-7H2,2,4-5H3
IUPAC name chemrof:IUPAC_name 1,3-Butyleneglycol dimethacrylate
Molecular formula chemrof:molecular_formula C12H18O4
Molecular mass chemrof:molecular_mass 226.272
Monoisotopic mass chemrof:monoisotopic_mass 226.120509, 226.12051
SMILES string chemrof:smiles_string C=C(C)C(=O)OCCC(C)OC(=O)C(=C)C

Known URLs

13

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=1189-08-8 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=27435-31-0 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:189312 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.013.374 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.64079.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5044784 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3183434 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/OL56191M6N enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0244160 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J85.378J enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/70916 enrich_references.pubchem_compound
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/2286802 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27285715 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
17940dcb-1a81-4b86-8608-4361048e6779 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
d57f155b-0a98-45d1-ac06-8feb8516814c Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
ed07f499-85ad-490c-99a1-06e25fcb23cf Environmental → Air → Indoor EF 3.1 kg 4
cb642f4a-09a8-46bb-9cb7-1b4878e664bc Environmental → Air → Long-term EF 3.1 kg 0
3979d79f-1755-4ba1-b7bf-4a1b782c528a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
49e870a8-7ac5-449d-8ec3-6a364a1a5fa1 Environmental → Air → Unknown EF 3.1 kg 4
a202bd05-2c42-4305-ab04-92f50e80cca2 Environmental → Ground → Agricultural EF 3.1 kg 4
a052ff11-39aa-4365-8c83-5985823157b7 Environmental → Ground → Non-agricultural EF 3.1 kg 4
a407dbe4-f763-411f-84bb-eed2e495c9c0 Environmental → Ground → Unknown EF 3.1 kg 4
0950ac06-a140-4c24-aa44-430a0e799a9a Environmental → Water → Long-term EF 3.1 kg 0
e04e1d57-7b49-4f83-91f6-5dbbd0bbf46e Environmental → Water → Ocean EF 3.1 kg 4
78627de3-1088-40ff-b683-7a2e9535caba Environmental → Water → Surface water EF 3.1 kg 4
02d5482c-028c-4c65-9734-27a0dcaa4b6f Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
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  ],
  "altLabel": [
    {
      "@value": "1,3-Butanediol, dimethacrylate",
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    },
    {
      "@value": "1,3-Butanediyl dimethacrylate",
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      }
    },
    {
      "@value": "1,3-Butylene dimethacrylate",
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      }
    },
    {
      "@value": "1-Methyltrimethylene methacrylate",
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    {
      "@value": "NK Ester BG",
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    },
    {
      "@value": "Rocryl X 970",
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