Consensus flow list

Acetamiprid (iso); (1e)-n-[(6-chloropyridin-3-yl)methyl]-n'-cyano-n-methylethanimidamide; (e)-n1-[(6-chloro-3-pyridyl)methyl]-n2-cyano-n1-methylacetamidine

fo-757f45aff68c1a1e

Identity

Type
NeutralMolecule
CAS
135410-20-7
EC
603-921-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Acetamiprid (iso); (1e)-n-[(6-chloropyridin-3-yl)methyl]-n'-cyano-n-methylethanimidamide; (e)-n1-[(6-chloro-3-pyridyl)methyl]-n2-cyano-n1-methylacetamidine

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

What it is used for

3

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. ChEBI
insecticide CHEBI:24852 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. ChEBI
pesticide CHEBI:25944 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. ChEBI

Alternative labels

31

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string WCXDHFDTOYPNIE-RIYZIHGNSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3/b14-8+
Isomeric SMILES string chemrof:isomeric_smiles_string C/C(=N\C#N)N(C)Cc1ccc(Cl)nc1
IUPAC name chemrof:IUPAC_name (1E)-N-[(6-chloropyridin-3-yl)methyl]-N'-cyano-N-methylethanimidamide
Molecular formula chemrof:molecular_formula C10H11ClN4
Molecular mass chemrof:molecular_mass 222.679
Monoisotopic mass chemrof:monoisotopic_mass 222.06722, 222.067224
SMILES string chemrof:smiles_string CC(=NC#N)N(C)Cc1ccc(Cl)nc1

Known URLs

7

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=135410-20-7 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:39164 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C18507 enrich_references.chebi_xrefs
pesticides pesticides:acetamiprid enrich_references.chebi_xrefs
ppdb ppdb:11 enrich_references.chebi_xrefs
reaxys reaxys:8315700 enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Acetamiprid enrich_references.chebi_xrefs

Elementary flows

15
Flow Context Source Unit CFs
25872eaa-1ec8-47d5-b87d-9e94fe4e299e Environmental → Air → Aircraft cruise height EF 3.1 kg 4
25750f96-adad-463a-8a25-0327f594afca Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
b456451c-5e72-4d4a-9f3a-746713c82914 Environmental → Air → Indoor EF 3.1 kg 4
8b7b0081-a271-412f-917b-e111daebe058 Environmental → Air → Long-term EF 3.1 kg 0
6593d291-38c8-4bdf-a5dc-39babbb93bd8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
6ac995d1-ef12-49de-bc4e-f026696df017 Environmental → Air → Unknown EF 3.1 kg 4
0523efe9-c00c-487a-8a91-203fb9d75b50 Environmental → Ground → Agricultural EF 3.1 kg 4
b65150a5-c168-4f8b-9d1a-d56e24e558d3 Environmental → Ground → Non-agricultural EF 3.1 kg 4
03a6def5735db44575c428d31ef94aae5017c53b Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
fddd696d-74b8-4122-b319-6aa8623f774e Environmental → Ground → Unknown EF 3.1 kg 4
f6fcaeb8-c92c-497c-b2d0-ef05cacc023d Environmental → Water → Long-term EF 3.1 kg 0
6caf70b4-576c-40c6-964c-807e70ecfaab Environmental → Water → Ocean EF 3.1 kg 4
9c49bc72-0715-42d5-bc16-dd3173afb9ad Environmental → Water → Surface water EF 3.1 kg 4
148de1bb758070ce4f2dfa395f51d77392dbb6a6 Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
d4dad134-9385-4fdb-b606-1519ea4b0cc9 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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}

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