Introduction：Basic information about CAS 374063-97-5|2-[4-(4-hydroxybut-2-ynyl)piperazin-1-yl]-3-nitrobenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-[4-(4-hydroxybut-2-ynyl)piperazin-1-yl]-3-nitrobenzoic acid |
|---|
| CAS Number | 374063-97-5 | Molecular Weight | 319.31300 |
|---|
| Density | 1.397g/cm3 | Boiling Point | 549.7ºC at 760 mmHg |
|---|
| Molecular Formula | C15H17N3O5 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 286.3ºC |
|---|
Names
| Name | 2-[4-(4-hydroxybut-2-ynyl)piperazin-1-yl]-3-nitrobenzoic acid |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.397g/cm3 |
|---|
| Boiling Point | 549.7ºC at 760 mmHg |
|---|
| Molecular Formula | C15H17N3O5 |
|---|
| Molecular Weight | 319.31300 |
|---|
| Flash Point | 286.3ºC |
|---|
| Exact Mass | 319.11700 |
|---|
| PSA | 109.83000 |
|---|
| LogP | 0.93680 |
|---|
| Index of Refraction | 1.633 |
|---|
| InChIKey | WRELIIJZMKMRMP-UHFFFAOYSA-N |
|---|
| SMILES | O=C(O)c1cccc([N+](=O)[O-])c1N1CCN(CC#CCO)CC1 |
|---|
Safety Information
| Hazard Codes | Xi: Irritant; |
|---|
| HS Code | 2933599090 |
|---|
Customs
| HS Code | 2933599090 |
|---|
| Summary | 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
|---|
Synonyms
| 2-[4-(4-Hydroxybut-2-yn-1-yl)piperazin-1-yl]-3-nitrobenzoic acid |
| GL-0033 |
