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benzotriazole

chemical compound
Class type of: heterocyclic compound, benzotriazole Q220672
benzotriazole
Def2010 · Public Domain · Wikimedia

Facts

7 properties
Instance of
type of chemical entity
Subclass of
heterocyclic compound, benzotriazole[4][5]
Canonical SMILES
C1=CC2=NNN=C2C=C1[2]
Chemical formula
C₆H₅N₃[3]
Has part(s)
nitrogen, carbon[6][7]
Mass
+119.048[8]
Melting point
+97.3, +98.0[9][10]
🏷️ Also known as
en BTA en 1,2,3-Benzotriazole en 1,2,3-triaza-1H-indene en 1,2,-aminozophenylene en 1H-Benzotriazole en 2,3-diazaindole en azimidobenzene en aziminobenzene en benzene azimide en benzisotriazole en benzotriazole cs benzotriazol fa بنزوتریازول fi bentsotriatsoli hi बेन्जोट्रायाजोल it 1H-benzotriazolo ja ベンゾトリアゾール nl Benzotriazool ru бензотриазол zh 苯并三唑
🔖 Identifiers · 34
OpenAlex ID
C2777844968
Art & Architecture Thesaurus ID
300379560
CAMEO Chemicals ID
19869
CAS Registry Number
95-14-7
ChEBI ID
75331
ChEMBL ID
CHEMBL84963
ChemSpider ID
6950
CosIng number
32149
DSSTOX compound identifier
DTXCID00147
DSSTox substance ID
DTXSID6020147
EC number
202-394-1
ECHA Substance Infocard ID
100.002.177
Show all 34 identifiers +22
Freebase ID
/m/02r90_q
HSDB ID
4143
Human Metabolome Database ID
HMDB0244873
ICSC ID
1091
InChI
InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)
InChIKey
QRUDEWIWKLJBPS-UHFFFAOYSA-N
MassBank accession ID
SM819701, SM879903, MSBNK-Eawag-EA016601, MSBNK-Eawag-EA016602, MSBNK-Eawag-EA016603, MSBNK-Eawag-EA016604, MSBNK-Eawag-EA016605, MSBNK-Eawag-EA016606, MSBNK-Eawag-EA016607, MSBNK-Eawag-EA016608, MSBNK-Eawag-EA016609, MSBNK-Eawag-EA016610, MSBNK-Eawag-EA016611, MSBNK-Eawag-EA016612, MSBNK-Eawag-EA016613, MSBNK-Eawag-EA016614, MSBNK-Eawag-EA016651, MSBNK-Eawag-EA016652, MSBNK-Eawag-EA016653, MSBNK-Eawag-EA016654, MSBNK-Eawag-EA016655, MSBNK-Eawag-EA016656, MSBNK-Eawag-EA016657, MSBNK-Eawag-EA016658, MSBNK-Eawag-EA016659, MSBNK-Eawag-EA016660, MSBNK-Eawag-EA016661, MSBNK-Eawag-EA016662, MSBNK-Eawag-EA016663, MSBNK-Eawag-EA016664, MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00161, MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00162, MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00163, MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00165, MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00166, MSBNK-Env_Anal_Chem_U_Tuebingen-TUE00167, MSBNK-Athens_Univ-AU405002, MSBNK-Athens_Univ-AU405003, MSBNK-Athens_Univ-AU405007, MSBNK-Athens_Univ-AU405008, MSBNK-Athens_Univ-AU405009, MSBNK-Athens_Univ-AU241457, MSBNK-Fac_Eng_Univ_Tokyo-JP011064, MSBNK-Athens_Univ-AU241462, MSBNK-Athens_Univ-AU241458, MSBNK-KWR-KW107802, MSBNK-KWR-KW107803, MSBNK-KWR-KW107804, MSBNK-UFZ-UA000201, MSBNK-UFZ-UA000202, MSBNK-UFZ-UA000203, MSBNK-UFZ-UF417701, MSBNK-UFZ-UF417702, MSBNK-UFZ-UF417703, MSBNK-UFZ-UF417704
MeSH descriptor ID
C012771
Microsoft Academic ID (discontinued)
2777844968
NMRShiftDB structure ID
30096608
NSC number
3058
PDB ligand ID
0CT
PDB structure ID
3UZJ
PesticideInfo chemical ID
PRI167
PubChem CID
7220
RTECS number
DM1225000
Reaxys registry number
112133
SPLASH
splash10-00di-2900000000-2bd4eb014091ba3a2ed3, splash10-00di-0900000000-e671c497e21f9de3fbd3, splash10-00di-0900000000-a0e38aa79de0d1a0c588, splash10-00di-0900000000-4745f00e807a3e212e33, splash10-00di-0900000000-e4c0501bfb4bc4c9ce1a, splash10-00di-0900000000-5c7f4cfd06fa9485049e, splash10-00di-2900000000-121ffcfc750601cdde28, splash10-00di-6900000000-0a16947d09a15a319842, splash10-00di-0900000000-b43f1c8d7809a4bcaa6e, splash10-00di-0900000000-fbefc3bcafdb1956dd2a, splash10-00di-0900000000-052d0f4cdfeb66d63d4e, splash10-00di-0900000000-28c898d2b1fba02de825, splash10-00di-2900000000-394e039deaff08c47e14, splash10-00di-5900000000-4df6890f3c7275150ddb, splash10-00di-0900000000-f72837d6d6ee334da0a2, splash10-014i-0900000000-fff4faeb210a6405ae65, splash10-014i-0900000000-8d7e074f986abcf251a3, splash10-014i-0900000000-e9730f87b5c38f0f3ab7, splash10-014i-0900000000-2e138ebf20831488f629, splash10-014i-2900000000-cb21e7150daddee42200, splash10-014i-3900000000-2276bea9bd3f45381183, splash10-014i-0900000000-008243f48922c572318d, splash10-014i-0900000000-ec47f1e01005a1933d0d, splash10-014i-0900000000-02c2899c2528ee7d7db0, splash10-014i-1900000000-78fe3cce753b5d4e2f64, splash10-014i-2900000000-330a02ef980a5f5b37e3, splash10-00di-0900000000-0b0dae971809bf7172e7, splash10-01b9-9400000000-79f1def14297918ce9e5, splash10-014r-9000000000-d9699dacd116634c4576, splash10-014i-1900000000-ded2c78759aedc48447d, splash10-014l-9700000000-fdef96d75244bf97cc16, splash10-0udi-9000000000-ba08f2ca031e44164696, splash10-03xu-9200000000-14c60454b23abfdc1f33, splash10-00di-0900000000-b8f0ff11fdc6b53437e2, splash10-00di-1900000000-0b633b8089284e0d4c89, splash10-0006-9000000000-8645433d4b4455ae7e36, splash10-014i-0900000000-47d2c81043e4207141ae, splash10-00di-0900000000-528ebf7ce90aaee406bc, splash10-00di-5900000000-b88bcf5b7eb3ff091ccb, splash10-0006-9000000000-a46e19218e16d51b62e6, splash10-0006-9000000000-f7275697c4d75c16bc1e
SureChEMBL ID
8956, 171464
UNII
86110UXM5Y
UniChem compound ID
619093
ZVG number
570075

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🔗 Connections
Has part(s) 2
carbon, nitrogen
Subclass of 1
heterocyclic compound
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Summary

benzotriazole is a type of chemical entity[1].

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

  1. [2] ↑ . PubChem. Retrieved . wikidata.org.
  2. [3] ↑ . PubChem. Retrieved . wikidata.org.
  3. [4] ↑ . wikidata.org.
  4. [5] ↑ . wikidata.org.
  5. [6] ↑ . wikidata.org.
  6. [7] ↑ . wikidata.org.
  7. [8] ↑ . PubChem. Retrieved . wikidata.org.
  8. [9] ↑ . wikidata.org.
  9. [10] ↑ . Jean-Claude Bradley Open Melting Point Dataset. wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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APA 4ort.xyz Knowledge Graph. (2026). benzotriazole. Retrieved November 8, 2026, from https://4ort.xyz/entity/benzotriazole
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Edit History

Rolling log of changes to this entity's Wikidata record. Values shown reflect the current state of each edited property — follow the history link to see the precise diff for any edit.

  1. 20w ago · Nabbegat · 2026-06-19 view diff on Wikidata ↗
    Has parts → —
    Instance of → type of chemical entity
    Subclass of → —
    Aliases → —
    + 5 other properties edited (see Wikidata diff for full list)
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