3-bromopropene

1-Bromo-2-propene
1-Propene, 3-bromo-
13125C
2-Propenyl bromide
3-Bromo-1-propene
3-Bromoprop-1-ene
3-Bromopropylene
Allyl bromide
Propene, 3-bromo-

Property	Value
InChI2D key string chemrof:inchi2d_key_string	BHELZAPQIKSEDF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C3H5Br/c1-2-3-4/h2H,1,3H2
IUPAC name chemrof:IUPAC_name	3-bromopropene
Molecular formula chemrof:molecular_formula	C3H5Br
Molecular mass chemrof:molecular_mass	120.977
Monoisotopic mass chemrof:monoisotopic_mass	119.957462
SMILES string chemrof:smiles_string	C=CCBr

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=106-95-6	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.003.134	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID8024442	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7596	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1429506	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FXQ8X2F74Z	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.040A	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/7841	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#1099	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q223062	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Allyl_bromide	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
51381d8b-a3c8-4ad8-95ec-45cb5c8b9299	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
1654ef77-1645-4e4e-95bb-8e8310194928	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
ac1d57f0-ab52-444b-90bb-7173baa11a79	Environmental → Air → Indoor	EF 3.1	kg	2
a30a924a-3f7d-48d5-8f88-f964e4cb199b	Environmental → Air → Long-term	EF 3.1	kg	0
68ccd1a2-7268-4e06-971c-bbc67b1125fd	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
2440f47a-fa65-4009-a660-39adff49087c	Environmental → Air → Unknown	EF 3.1	kg	2
435bfbf0-e423-4460-9609-4f1dfea1cc14	Environmental → Ground → Agricultural	EF 3.1	kg	2
ea47f45a-260a-42ab-9a02-b6bf6f199b2e	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
bb545850-856c-40af-b88e-035809474c91	Environmental → Ground → Unknown	EF 3.1	kg	2
68cb7564-1370-45ae-9da9-ddb1d66dfd13	Environmental → Water → Long-term	EF 3.1	kg	0
a9701d29-a242-4ac6-b1f5-09411f5db75a	Environmental → Water → Ocean	EF 3.1	kg	2
4591634c-77cd-4b34-ae42-f4fe45f852d4	Environmental → Water → Surface water	EF 3.1	kg	2
2904a981-5373-49ae-b2fb-d76630b6b562	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-5ca193297ee016d8",
  "prefLabel": [
    {
      "@value": "3-bromopropene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1-Bromo-2-propene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "CAS:106-95-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=106-95-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Propene, 3-bromo-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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          "CAS:106-95-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=106-95-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "13125C",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=106-95-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Propenyl bromide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3-Bromo-1-propene",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3-Bromoprop-1-ene",
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    },
    {
      "@value": "3-Bromopropylene",
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    },
    {
      "@value": "Allyl bromide",
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    },
    {
      "@value": "Propene, 3-bromo-",
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}

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3-bromopropene

Identity

Structure

Alternative labels

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Elementary flows

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