
CAS Number116834-08-3
Synonyms1-phenyl-5-pyrrolylpyrazole-4-carboxylic acid; 1H-Pyrazole-4-carboxylicacid,1-phenyl-5-(1H-pyrrol-1-yl); 1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid; 1-phenyl-5-pyrrol-1-yl-1H-pyrazole-4-carboxylic acid
Molecular FormulaC17H13FN2O2
Molecular Weight253.25600
Purity96+%
Density1.3g/cm3
Boiling Point468.8ºC at 760mmHg
Melting Point185-189ºC
Appearancesolid
EINECS0
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 116834-08-3 |
| Catalog No. | 2A-0109645 |
| Chinese Name | 1-苯基-5-(1H-吡咯-1-基)-1H-吡唑-4-羧酸 |
| Synonyms | 1-phenyl-5-pyrrolylpyrazole-4-carboxylic acid; 1H-Pyrazole-4-carboxylicacid,1-phenyl-5-(1H-pyrrol-1-yl); 1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxylic acid; 1-phenyl-5-pyrrol-1-yl-1H-pyrazole-4-carboxylic acid |
| Molecular Formula | C17H13FN2O2 |
| Molecular Weight | 253.25600 |
| Purity | 96+ |
| Density | 1.3g/cm3 |
| Boiling Point | 468.8ºC at 760mmHg |
| Melting Point | 185-189ºC |
| Appearance | solid |
| EINECS | 0 |
| HTC | 2933990090 |
| UN(IATA) | 0 |
| PubChem ID | 329815960 |
| MDL Number | MFCD08445975 |
| SMILES | OC(=O)c1cc(nn1Cc2ccc(F)cc2)-c3ccccc3 |
| InChI | 1S/C17H13FN2O2/c18-14-8-6-12(7-9-14)11-20-16(17(21)22)10-15(19-20)13-4-2-1-3-5-13/h1-10H,11H2,(H,21,22) |
| InChI Key | SIYPTOKQFSRFPU-UHFFFAOYSA-N |
| NACRES Code | NA.21 |
| UNSPSC | 12352106 |
| MSDS | msds/109645_1_116834_08_3.pdf |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: 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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