Benzotriazole
fo-3114f681212d8c16
Identity
- Type
- Neutral molecule
- CAS
- 95-14-7
- EC
- 202-394-1
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
What it is used for
1
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 |
Alternative labels
38- 1,2,-aminozophenylene
- 1,2,3-1H-Benzotriazole
- 1,2,3-Benzotriazole
- 1,2,3-triaza-1H-indene
- 1,2,3-Triazaindene
- 1,2-Aminoazophenylene
- 1H-1,2,3-Benzotriazole
- 1H-Benzo[d]-1,2,3-triazole
- 1H-benzotriazole
- 2,3-diazaindole
- Ascotoran L
- azimidobenzene
- aziminobenzene
- benzene azimide
- benzisotriazole
- Benzo[d][1,2,3]triazole
- Benzotriazole R
- BT 120SG
- BTA
- C.V.I. Liquid
- Cobratec 35G
- Cobratec 99
- CVI
- D 32-108
- Entek
- Fujilite BT 20NM
- Irgamet BTZ
- Irgastab I 489
- Kemitec BT-P
- Kemitec TT
- Miracle HP 16
- Preventol BZT
- Rusmin R
- Seetec BT
- Seetec BT-R
- TH-BTA
- Verzone Crystal
- Wintrol B-FG
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | QRUDEWIWKLJBPS-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9) |
| IUPAC name chemrof:IUPAC_name | Benzotriazole |
| Molecular formula chemrof:molecular_formula | C6H5N3 |
| Molecular mass chemrof:molecular_mass | 119.127 |
| Monoisotopic mass chemrof:monoisotopic_mass | 119.048347, 119.04835 |
| SMILES string chemrof:smiles_string | c1ccc2[nH]nnc2c1 |
Known URLs
21Where 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=95-14-7 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:75331 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.177 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1091 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6020147 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=3058 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL84963 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/86110UXM5Y | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0244873 | enrich_references.pubchem_identifier_url |
| hts.usitc.gov | https://hts.usitc.gov/search?query=2933.99.82.10 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J259.309B | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.709K | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=143517 | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:0CT | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7220 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=045556 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23652707 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23923790 | enrich_references.chebi_xrefs |
| reaxys | reaxys:112133 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q220672 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Benzotriazole | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| e2fb52f8-6555-11dd-ad8b-0800200c9a66 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a263-0050c2490048 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 6e58225c-d92a-4db3-ab74-b7f0b2f16705 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a262-0050c2490048 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| fe0acd60-3ddc-11dd-a264-0050c2490048 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a261-0050c2490048 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 4d9a8790-3ddd-11dd-94aa-0050c2490048 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a268-0050c2490048 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a260-0050c2490048 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a266-0050c2490048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| fe0acd60-3ddc-11dd-a269-0050c2490048 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a265-0050c2490048 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| fe0acd60-3ddc-11dd-a267-0050c2490048 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (58 changes)
Full record
Flow object JSON
{
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},
{
"@value": "Benzotriazole R",
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{
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},
{
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{
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{
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{
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},
{
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{
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{
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},
{
"@value": "Fujilite BT 20NM",
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},
{
"@value": "Irgamet BTZ",
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},
{
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}
},
{
"@value": "Kemitec BT-P",
"@language": "en",
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}
},
{
"@value": "Kemitec TT",
"@language": "en",
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}
},
{
"@value": "Miracle HP 16",
"@language": "en",
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},
{
"@value": "Preventol BZT",
"@language": "en",
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}
},
{
"@value": "Rusmin R",
"@language": "en",
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},
{
"@value": "Seetec BT",
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},
{
"@value": "Seetec BT-R",
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},
{
"@value": "TH-BTA",
"@language": "en",
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},
{
"@value": "Verzone Crystal",
"@language": "en",
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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