3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester
3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester structure
|
Common Name | 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester | ||
|---|---|---|---|---|
| CAS Number | 76923-16-5 | Molecular Weight | 230.26200 | |
| Density | 1.169g/cm3 | Boiling Point | 415.183ºC at 760 mmHg | |
| Molecular Formula | C13H14N2O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 204.896ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester |
|---|---|
| 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 | 1.169g/cm3 |
|---|---|
| Boiling Point | 415.183ºC at 760 mmHg |
| Molecular Formula | C13H14N2O2 |
| Molecular Weight | 230.26200 |
| Flash Point | 204.896ºC |
| Exact Mass | 230.10600 |
| PSA | 54.98000 |
| LogP | 2.56180 |
| Index of Refraction | 1.57 |
| InChIKey | NIVCIGONLNLBNV-UHFFFAOYSA-N |
| SMILES | CCOC(=O)c1c(-c2ccccc2)n[nH]c1C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933199090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~80%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Shen, Quansheng; Huang, Wen; Wang, Jialiang; Zhou, Xigeng Organic Letters, 2007 , vol. 9, # 22 p. 4491 - 4494 |
|
~87%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Plath, Peter; Rohr, Wolfgang Synthesis, 1982 , # 4 p. 318 - 320 |
|
~93%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Emelina, E. E.; Ermakov, N. V.; Ershov, B. A.; Zelenin, A. K. Russian Journal of Organic Chemistry, 1994 , vol. 30, # 10 p. 1637 - 1639 Zhurnal Organicheskoi Khimii, 1994 , vol. 30, # 10 p. 1554 - 1555 |
|
~59%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Emelina, E. E.; Ershov, B. A.; Zelenin, A. K.; Selivanov, S. I. Russian Journal of Organic Chemistry, 1994 , vol. 30, # 10 p. 1630 - 1636 Zhurnal Organicheskoi Khimii, 1994 , vol. 30, # 10 p. 1548 - 1553 |
|
~%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Plath, Peter; Rohr, Wolfgang Synthesis, 1982 , # 4 p. 318 - 320 |
|
~%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Plath, Peter; Rohr, Wolfgang Synthesis, 1982 , # 4 p. 318 - 320 |
|
~%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: De; Dutt Journal of the Indian Chemical Society, 1930 , vol. 7, p. 480 Chem. Zentralbl., 1930 , vol. 101, # II p. 3024 |
|
~%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: De; Dutt Journal of the Indian Chemical Society, 1930 , vol. 7, p. 480 Chem. Zentralbl., 1930 , vol. 101, # II p. 3024 |
|
~%
3-methyl-5-phen... CAS#:76923-16-5 |
| Literature: Sandstroem Arkiv foer Kemi, 1956 , vol. 8, p. 487,502 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933199090 |
|---|---|
| Summary | 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| ethyl 3-methyl-5-phenyl-1H-pyrazole-4-carboxylate |
| 3-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: The English name of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester. |
| Q: What is the SMILES notation of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: SMILES notation of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is CCOC(=O)c1c(-c2ccccc2)n[nH]c1C. |
| Q: What English synonyms does 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester have? |
| A: English synonyms of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester: ethyl 3-methyl-5-phenyl-1H-pyrazole-4-carboxylate, 3-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID. |
| Q: What is the CAS number of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: CAS number of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is 76923-16-5. |
| Q: What is the boiling point of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: Boiling point of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is 415.183ºC at 760 mmHg. |
| Q: What is the polar surface area (PSA) of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: Polar surface area (PSA) of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is 54.98000. |
| Q: What is the molecular weight of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: Molecular weight of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is 230.26200. |
| Q: What is the LogP of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: LogP of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is 2.56180. |
| Q: What is the InChIKey of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: InChIKey of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is NIVCIGONLNLBNV-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester? |
| A: Molecular formula of 3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester is C13H14N2O2. |
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. |