N'-tert-butyl-n'-(3,5-dimethylbenzoyl)-5-methyl-3,4-dihydro-2h-1-benzopyran-6-carbohydrazide
fo-6b94d50cf4f22b5b
Identity
- Type
- Neutral molecule
- CAS
- 143807-66-3
- EC
- 604-382-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
What it is used for
2
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 |
|---|---|---|
| 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
4- 2H-1-Benzopyran-6-carboxylic acid, 3,4-dihydro-5-methyl-, 2-(3,5-dimethylbenzoyl)-2-(1,1-dimethylethyl)hydrazide
- chromafenozide
- Matric
- N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methylchromane-6-carbohydrazide
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | HPNSNYBUADCFDR-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27) |
| IUPAC name chemrof:IUPAC_name | N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-5-methylchromane-6-carbohydrazide |
| Molecular formula chemrof:molecular_formula | C24H30N2O3 |
| Molecular mass chemrof:molecular_mass | 394.515 |
| Monoisotopic mass chemrof:monoisotopic_mass | 394.22564, 394.225643 |
| SMILES string chemrof:smiles_string | Cc1cc(C)cc(C(=O)N(NC(=O)c2ccc3c(c2C)CCCO3)C(C)(C)C)c1 |
Known URLs
15Where 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 |
|---|---|---|
| beilstein | beilstein:10113703 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=143807-66-3 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38450 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.114.216 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4057976 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL227020 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2ODM465D5M | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0250201 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.295.632K | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18515 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18515 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55870 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:1136 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/10157484 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q22807314 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 7bed3d36-3b60-4af7-a490-93b5360faffe | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| ec7869b2-b473-429d-8422-a527c26d0208 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 47937e32-6095-4c5c-8e53-f95f4728f6ab | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| de49ed52-0c72-42c7-88e7-1580e318a260 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| ee9a0d08-64ca-4811-adb4-af789c41e5e1 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 0f64bee0-8a14-44c5-9b5a-3fde01269712 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 3d148f40-3789-488e-90bb-04e89a0267a7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| c3f43926-0540-4989-91d1-3d2a7449a5de | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| c0e31271d2f73c90e42504ff21b235c43994942a | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 7b4e29a4-e12b-4e76-8848-87ab02dfb79d | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 14d0ed84-45e4-451e-acbd-3533cc0a9025 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 44364d39-f763-490a-b72a-d03963ddcc9c | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 2243c414-b768-4761-8094-ee3d22a99da5 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| a17e0c52-baf5-4ee9-ab32-21de335c8945 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works