112809-25-3
112809-25-3 structure
- Name: 4-(1H-1,2,4-Triazol-1-ylmethyl)benzonitrile
- Chemical Name: 4-((1H-1,2,4-Triazol-3-yl)methyl)benzonitrile
- CAS Number: 112809-25-3
- Molecular Formula: C10H8N4
- Molecular Weight: 184.197
- Create Date: 2018-10-12 19:08:44
- Modify Date: 2025-09-04 12:47:21
| Name | 4-((1H-1,2,4-Triazol-3-yl)methyl)benzonitrile |
|---|---|
| Synonyms |
4-[1-(1,2,4-triazolyl)-methyl]-benzonitrile
4-(1H-1,2,4-Triazol-1-ylmethyl)-benzonitrile Benzonitrile, 4-(1H-1,2,4-triazol-1-ylmethyl)- MFCD07368016 4-(1H-1,2,4-TRIAZOLYLMETHYL)BENZONITRILE 4-(1H-1,2,4-Triazol-1-ylmethyl)benzonitrile Letrozole Impurity 3 |
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 412.1±55.0 °C at 760 mmHg |
| Melting Point | 69-72ºC |
| Molecular Formula | C10H8N4 |
| Molecular Weight | 184.197 |
| Flash Point | 203.0±31.5 °C |
| Exact Mass | 184.074890 |
| PSA | 65.36000 |
| LogP | 0.55 |
| Vapour Pressure | 0.0±1.0 mmHg at 25°C |
| Index of Refraction | 1.643 |
| Hazard Codes | Xn:Harmful |
|---|---|
| Risk Phrases | R10;R20/21/22 |
| Safety Phrases | S16-S22-S36/37/39 |
| HS Code | 2933990090 |
|
~68%
112809-25-3 |
| Literature: US2007/66831 A1, ; Page/Page column 7-8 ; |
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~54%
112809-25-3 |
| Literature: European Journal of Medicinal Chemistry, , vol. 46, # 9 p. 4010 - 4024 |
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~%
112809-25-3 |
| Literature: WO2007/107733 A1, ; Page/Page column 13-14; 16-17 ; |
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112809-25-3 |
| Literature: WO2005/47269 A1, ; Page/Page column 7-8 ; |
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~%
112809-25-3 |
| Literature: WO2005/47269 A1, ; Page/Page column 7-8 ; |
| Precursor 4 | |
|---|---|
| DownStream 2 | |
| HS Code | 2933990090 |
|---|---|
| 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% |