2,2,4-trimethyl-7-(2-methylene-1-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one
2,2,4-trimethyl-7-(2-methylene-1-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one structure
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Common Name | 2,2,4-trimethyl-7-(2-methylene-1-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one | ||
|---|---|---|---|---|
| CAS Number | 116337-83-8 | Molecular Weight | 273.32700 | |
| Density | 1.096g/cm3 | Boiling Point | 480.3ºC at 760mmHg | |
| Molecular Formula | C16H19NO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 244.3ºC | |
Summary: 2,2,4-Trimethyl-7-(2-methylene-1-oxobutyl)-2H-1,4-benzoxazin-3(4H)-one (CAS号：116337-83-8)，molecular formula C16H19NO3，molecular weight 273.32700. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.096g/cm3 |
|---|---|
| Boiling Point | 480.3ºC at 760mmHg |
| Molecular Formula | C16H19NO3 |
| Molecular Weight | 273.32700 |
| Flash Point | 244.3ºC |
| Exact Mass | 273.13600 |
| PSA | 46.61000 |
| LogP | 3.03430 |
| Vapour Pressure | 2.2E-09mmHg at 25°C |
| Index of Refraction | 1.527 |
| InChIKey | XLZPUZPNBBONQU-UHFFFAOYSA-N |
| SMILES | C=C(CC)C(=O)c1ccc2c(c1)OC(C)(C)C(=O)N2C |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~82%
2,2,4-trimethyl... CAS#:116337-83-8 |
| Literature: Moussavi; Depreux; Lesieur; Cotelle; Sauzieres; Plancke; Fruchart Farmaco, 1991 , vol. 46, # 2 p. 339 - 355 |
|
~%
2,2,4-trimethyl... CAS#:116337-83-8 |
| Literature: Moussavi; Depreux; Lesieur; Cotelle; Sauzieres; Plancke; Fruchart Farmaco, 1991 , vol. 46, # 2 p. 339 - 355 |
|
~%
2,2,4-trimethyl... CAS#:116337-83-8 |
| Literature: Moussavi; Depreux; Lesieur; Cotelle; Sauzieres; Plancke; Fruchart Farmaco, 1991 , vol. 46, # 2 p. 339 - 355 |
|
~%
2,2,4-trimethyl... CAS#:116337-83-8 |
| Literature: Moussavi; Depreux; Lesieur; Cotelle; Sauzieres; Plancke; Fruchart Farmaco, 1991 , vol. 46, # 2 p. 339 - 355 |
![1-[3-hydroxy-4-(methylamino)phenyl]butan-1-one structure](https://image.chemsrc.com/caspic/155/123172-48-5.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 0 | |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: Molecular formula of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is C16H19NO3. |
| Q: What is the molecular weight of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: Molecular weight of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is 273.32700. |
| Q: What is the English name of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: The English name of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one. |
| Q: What is the LogP of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: LogP of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is 3.03430. |
| Q: What is the boiling point of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: Boiling point of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is 480.3ºC at 760mmHg. |
| Q: What is the SMILES notation of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: SMILES notation of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is C=C(CC)C(=O)c1ccc2c(c1)OC(C)(C)C(=O)N2C. |
| Q: What are the upstream materials of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: Related upstream materials(CAS) of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one: 51-80-9;116337-75-8;21892-80-8;123172-48-5;80427-93-6. |
| Q: What is the InChIKey of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: InChIKey of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is XLZPUZPNBBONQU-UHFFFAOYSA-N. |
| Q: What is the Chinese name of 116337-83-8? |
| A: Chinese name of 116337-83-8 is 116337-83-8. |
| Q: What is the polar surface area (PSA) of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one? |
| A: Polar surface area (PSA) of 2,2,4-trimethyl-7-(2-methylidenebutanoyl)-1,4-benzoxazin-3-one is 46.61000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Dayang Chem (Hangzhou) Co., Ltd. |