Consensus flow list

Identity

Type
Neutral molecule
CAS
115-11-7
EC
204-066-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2-methyl-1-propene

Alternative labels

12

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string VQTUBCCKSQIDNK-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3
IUPAC name chemrof:IUPAC_name 2-methyl-1-propene
Molecular formula chemrof:molecular_formula C4H8
Molecular mass chemrof:molecular_mass 56.108
Monoisotopic mass chemrof:monoisotopic_mass 56.0626
SMILES string chemrof:smiles_string C=C(C)C

Known URLs

24

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=115-11-7 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=15220-85-6 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=18923-87-0 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=42278-27-3 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=7756-94-7 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=9003-27-4 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:43907 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.003.697 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1027 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9020748 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/QA2LMR467H enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0253606 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.465A enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:MEB enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8255 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1055 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#1075 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/22447372 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23069604 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23790119 enrich_references.chebi_xrefs
reaxys reaxys:773645 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/2099712 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q776976 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Isobutylene enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
f2154a5e-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 7
fe0acd60-3ddc-11dd-ab46-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 7
db640451-ef2d-4411-999c-6c6c8aa5f539 Environmental → Air → Indoor EF 3.1 kg 6
fe0acd60-3ddc-11dd-ab45-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 1
fe0acd60-3ddc-11dd-ab47-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 7
fe0acd60-3ddc-11dd-ab44-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 7
f2154a5c-6555-11dd-ad8b-0800200c9a66 Environmental → Ground → Agricultural EF 3.1 kg 6
f2154a5f-6555-11dd-ad8b-0800200c9a66 Environmental → Ground → Non-agricultural EF 3.1 kg 6
f2154a61-6555-11dd-ad8b-0800200c9a66 Environmental → Ground → Unknown EF 3.1 kg 6
f2154a63-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Long-term EF 3.1 kg 0
f2154a60-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Ocean EF 3.1 kg 6
f2154a5d-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Surface water EF 3.1 kg 6
f2154a62-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Unknown EF 3.1 kg 6

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
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  "altLabel": [
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      "@value": "1,1-Dimethylethene",
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