Consensus flow list

Cyhalofop

fo-cae095ed26727e73

Identity

Type
Neutral molecule
CAS
122008-78-0
EC
808-439-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
53 across every transformer

Structure

Structure diagram for Cyhalofop

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string ROBSGBGTWRRYSK-SNVBAGLBSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H12FNO4/c1-10(16(19)20)21-12-3-5-13(6-4-12)22-15-7-2-11(9-18)8-14(15)17/h2-8,10H,1H3,(H,19,20), InChI=1S/C16H12FNO4/c1-10(16(19)20)21-12-3-5-13(6-4-12)22-15-7-2-11(9-18)8-14(15)17/h2-8,10H,1H3,(H,19,20)/t10-/m1/s1
Isomeric SMILES string chemrof:isomeric_smiles_string C[C@H](C(=O)O)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C#N)F
IUPAC name chemrof:IUPAC_name (2R)-2-[4-(4-cyano-2-fluoranyl-phenoxy)phenoxy]propanoic acid, (2R)-2-[4-(4-cyano-2-fluoro-phenoxy)phenoxy]propanoic acid, (2R)-2-[4-(4-cyano-2-fluoro-phenoxy)phenoxy]propionic acid, (2R)-2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoic acid, 2-[4-(4-cyano-2-fluoranyl-phenoxy)phenoxy]propanoic acid, 2-[4-(4-cyano-2-fluoro-phenoxy)phenoxy]propanoic acid, 2-[4-(4-cyano-2-fluoro-phenoxy)phenoxy]propionic acid, 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]propanoic acid
Molecular formula chemrof:molecular_formula C16H12FNO4
Molecular mass chemrof:molecular_mass 301.273
Monoisotopic mass chemrof:monoisotopic_mass 301.075036
SMILES string chemrof:smiles_string CC(Oc1ccc(Oc2ccc(C#N)cc2F)cc1)C(=O)O

Known URLs

8

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=122008-78-0 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.236.396 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID701022032 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/58150F267D enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J787.471E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/15118047 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/15118048 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27261536 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
a50cce8f-9c25-4d6e-88a0-399c29f59e44 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
3a3322c4-cbca-418d-acf6-fb400c3669e7 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
ec09daee-4140-4ff2-bc51-b31ae83e4019 Environmental → Air → Indoor EF 3.1 kg 2
43489f92-056b-45dd-9e12-06491a30ffa7 Environmental → Air → Long-term EF 3.1 kg 0
c583a1eb-fd19-4352-901f-88daefed7540 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
d6d45b56-0caf-4280-9c9e-c525f5249c44 Environmental → Air → Unknown EF 3.1 kg 2
be6d110f-0a7e-46cd-b146-b888adb303fc Environmental → Ground → Agricultural EF 3.1 kg 2
0cfa7724-8001-48a8-ace9-5efa7cb2c2d2 Environmental → Ground → Non-agricultural EF 3.1 kg 2
3144e5d84c91668c9e164f97295a7ec60d8d4d1a Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
3c54cccc-7ddc-440e-9c15-6d2f97a47f93 Environmental → Ground → Unknown EF 3.1 kg 2
e917c7a7-b130-4d3b-b758-3543fc09cc0e Environmental → Water → Long-term EF 3.1 kg 0
d95f6b15-0897-4293-a02a-58fa1a10a345 Environmental → Water → Ocean EF 3.1 kg 2
b9dd0df5-968a-4edb-87f0-a89d88cb8705 Environmental → Water → Surface water EF 3.1 kg 2
84162fd5-7b87-4b7a-81cd-a4b88bca19c2 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (53 changes)

Open the changes page

Full record

Flow object JSON 
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