Introduction：Basic information about CAS 73953-89-6|1-benzyl-1,2,3-triazole-4,5-dicarboxylic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-benzyl-1,2,3-triazole-4,5-dicarboxylic acid |
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| CAS Number | 73953-89-6 | Molecular Weight | 247.20700 |
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| Density | / | Boiling Point | 558.5ºC at 760 mmHg |
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| Molecular Formula | C11H9N3O4 | Melting Point | 181-182°C |
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| MSDS | / | Flash Point | 291.6ºC |
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Names
| Name | 1-benzyltriazole-4,5-dicarboxylic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Boiling Point | 558.5ºC at 760 mmHg |
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| Melting Point | 181-182°C |
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| Molecular Formula | C11H9N3O4 |
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| Molecular Weight | 247.20700 |
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| Flash Point | 291.6ºC |
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| Exact Mass | 247.05900 |
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| PSA | 105.31000 |
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| LogP | 0.72280 |
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| InChIKey | IYYBUXUZYWGZGB-UHFFFAOYSA-N |
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| SMILES | O=C(O)c1nnn(Cc2ccccc2)c1C(=O)O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XZ4580000
- CHEMICAL NAME :
- v-Triazole-4,5-dicarboxylic acid, 1-benzyl-
- CAS REGISTRY NUMBER :
- 73953-89-6
- BEILSTEIN REFERENCE NO. :
- 0029417
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C11-H9-N3-O4
- MOLECULAR WEIGHT :
- 247.23
- WISWESSER LINE NOTATION :
- T5NNNJ A1R& DVQ EVQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#05101
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Safety Information
| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S36 |
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| RTECS | XZ4580000 |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 1-benzyl-1H-[1,2,3]-triazole-4,5-dicarboxylic acid |
| 1-Benzyl-1,2,3-triazole-4,5-dicarboxylic acid |
| 1-Benzyl-1H-1,2,3-triazol-4,5-dicarbonsaeure |
| 1H-1,2,3-Triazole-4,5-dicarboxylic acid,1-(phenylmethyl) |
| v-Triazole-4,5-dicarboxylic acid,1-benzyl |
| MFCD00043512 |
