Guazatine
fo-6f41a775a5715b25
Identity
- Type
- Neutral molecule
- CAS
- 13516-27-3
- EC
- 236-855-3
- Origin
- ecoinvent-3.12 hybrid_name_cas_v1
- Changes
- 0 across every transformer
Structure
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 |
|---|---|---|
| agrochemical CHEBI:33286 | An agrochemical is a substance that is used in agriculture or horticulture. | ChEBI |
| fungicide CHEBI:24127 | A substance used to destroy fungal pests. | 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
1- 1,1'-(iminodioctane-8,1-diyl)diguanidine
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | RONFGUROBZGJKP-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C18H41N7/c19-17(20)24-15-11-7-3-1-5-9-13-23-14-10-6-2-4-8-12-16-25-18(21)22/h23H,1-16H2,(H4,19,20,24)(H4,21,22,25) |
| IUPAC name chemrof:IUPAC_name | 1,1'-(iminodioctane-8,1-diyl)diguanidine |
| Molecular formula chemrof:molecular_formula | C18H41N7 |
| Molecular mass chemrof:molecular_mass | 355.575 |
| Monoisotopic mass chemrof:monoisotopic_mass | 355.34234, 355.342344 |
| SMILES string chemrof:smiles_string | N=C(N)NCCCCCCCCNCCCCCCCCNC(=N)N |
Known URLs
7Where 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=13516-27-3 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:5569 | enrich_references.chebi_id_link |
| KEGG | https://www.genome.jp/entry/C10997 | enrich_references.chebi_xrefs |
| pdb-ccd | pdb-ccd:GZZ | enrich_references.chebi_xrefs |
| pesticides | pesticides:iminoctadine | enrich_references.chebi_xrefs |
| ppdb | ppdb:398 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1995978 | enrich_references.chebi_xrefs |
Elementary flows
7| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 9790afc03720c54e8eb6e29fad39fd06fdf19af4 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | ecoinvent algorithm addition | kg | 0 |
| f4de8c8b80ee47d44bb9c6b34e2c4d41c565bad0 | Environmental → Air → Unknown | ecoinvent algorithm addition | kg | 0 |
| d9dd5825ef8903437c45deb916a2f9a481175048 | Environmental → Ground → Agricultural | ecoinvent algorithm addition | kg | 0 |
| 10c7bb2cec7e7a9602bc4f26c9dc0d6184e7fab3 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 59ffba78e570eb64920c932fc9a07ccb4318cbe8 | Environmental → Ground → Unknown | ecoinvent algorithm addition | kg | 0 |
| 3b1e584cd1a13be1fc77e2cf45ecb17f473a6761 | Environmental → Water → Surface water | ecoinvent algorithm addition | kg | 0 |
| 95b839ac52afe8ca1530e7cc71fefb05181fcf7d | Environmental → Water → Unknown | ecoinvent algorithm addition | kg | 0 |
History
Everything that changed this substance (0 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