1,3a,7-triazaindene
1,3a,7-triazaindene structure
|
Common Name | 1,3a,7-triazaindene | ||
|---|---|---|---|---|
| CAS Number | 274-95-3 | Molecular Weight | 119.124 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C6H5N3 | Melting Point | 127-129ºC | |
| MSDS | USA | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Imidazo[1,2-a]pyrimidine |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Melting Point | 127-129ºC |
| Molecular Formula | C6H5N3 |
| Molecular Weight | 119.124 |
| Exact Mass | 119.048347 |
| PSA | 30.19000 |
| LogP | 0.41 |
| Index of Refraction | 1.689 |
| InChIKey | INSWZAQOISIYDT-UHFFFAOYSA-N |
| SMILES | c1cnc2nccn2c1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | 43 |
| Safety Phrases | 36/37 |
| HS Code | 2933990090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~75%
1,3a,7-triazaindene CAS#:274-95-3 |
| Literature: Loeber, Stefan; Huebner, Harald; Gmeiner, Peter Bioorganic & Medicinal Chemistry Letters, 1999 , vol. 9, # 1 p. 97 - 102 |
|
~67%
1,3a,7-triazaindene CAS#:274-95-3 |
| Literature: Kuenstlinger, M.; Breitmaier, E. Synthesis, 1983 , # 2 p. 161 - 162 |
|
~67%
1,3a,7-triazaindene CAS#:274-95-3 |
| Literature: Kuenstlinger, M.; Breitmaier, E. Synthesis, 1983 , # 2 p. 161 - 162 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| 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% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: Dissociation constant, pKa of the compound
Source: ChEMBL
Target: N/A
External Id: CHEMBL863765
|
|
Name: Distribution coefficient, log D at pH 7.4
Source: ChEMBL
Target: N/A
External Id: CHEMBL863769
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| imidazoapyrimidine |
| imidazo<1,2-a>pyrimidine |
| Imidazo[1,2-a]pyrimidine |
| 1,3a,7-triazaindene |
| imidazo<1,2-a>pirimidine |
| imidazo<1,2-a>pyridimine |
| 1,4,8-triaza-indene |
| markiertes Imidazo<1,2-a>pyrimidin |
| MFCD06245377 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for Imidazo[1,2-a]pyrimidine? |
| A: Safety information for Imidazo[1,2-a]pyrimidine: 36/37. |
| Q: What is the molecular weight of Imidazo[1,2-a]pyrimidine? |
| A: Molecular weight of Imidazo[1,2-a]pyrimidine is 119.124. |
| Q: What is the LogP of Imidazo[1,2-a]pyrimidine? |
| A: LogP of Imidazo[1,2-a]pyrimidine is 0.41. |
| Q: What is the melting point of Imidazo[1,2-a]pyrimidine? |
| A: Melting point of Imidazo[1,2-a]pyrimidine is 127-129ºC. |
| Q: What English synonyms does Imidazo[1,2-a]pyrimidine have? |
| A: English synonyms of Imidazo[1,2-a]pyrimidine: imidazoapyrimidine, imidazopyrimidine, Imidazo[1,2-a]pyrimidine, 1,3a,7-triazaindene, imidazopirimidine, imidazopyridimine, 1,4,8-triaza-indene, markiertes Imidazopyrimidin, MFCD06245377. |
| Q: What is the polar surface area (PSA) of Imidazo[1,2-a]pyrimidine? |
| A: Polar surface area (PSA) of Imidazo[1,2-a]pyrimidine is 30.19000. |
| Q: What is the InChIKey of Imidazo[1,2-a]pyrimidine? |
| A: InChIKey of Imidazo[1,2-a]pyrimidine is INSWZAQOISIYDT-UHFFFAOYSA-N. |
| Q: What is the CAS number of Imidazo[1,2-a]pyrimidine? |
| A: CAS number of Imidazo[1,2-a]pyrimidine is 274-95-3. |
| Q: What is the molecular formula of Imidazo[1,2-a]pyrimidine? |
| A: Molecular formula of Imidazo[1,2-a]pyrimidine is C6H5N3. |
| Q: What is the SMILES notation of Imidazo[1,2-a]pyrimidine? |
| A: SMILES notation of Imidazo[1,2-a]pyrimidine is c1cnc2nccn2c1. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |