1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID
Modify Date: 2025-08-25 18:09:46
1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID structure
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Common Name | 1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID | ||
|---|---|---|---|---|
| CAS Number | 96449-91-1 | Molecular Weight | 233.26300 | |
| Density | 1.273g/cm3 | Boiling Point | 478.7ºC at 760 mmHg | |
| Molecular Formula | C13H15NO3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 243.3ºC | |
| Name | 1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid |
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| Density | 1.273g/cm3 |
|---|---|
| Boiling Point | 478.7ºC at 760 mmHg |
| Molecular Formula | C13H15NO3 |
| Molecular Weight | 233.26300 |
| Flash Point | 243.3ºC |
| Exact Mass | 233.10500 |
| PSA | 57.61000 |
| LogP | 1.36600 |
| Index of Refraction | 1.595 |
| InChIKey | NBQXYAJLUDQSNV-UHFFFAOYSA-N |
| SMILES | Cc1ccc(CN2CC(C(=O)O)CC2=O)cc1 |
| HS Code | 2933790090 |
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~79%
1-(4-METHYL-BEN... CAS#:96449-91-1 |
| Literature: Takeda Chemical Industries, Ltd. Patent: EP1180513 A1, 2002 ; Location in patent: Referential example 59 ; EP 1180513 A1 |
| Precursor 2 | |
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| DownStream 0 | |
| HS Code | 2933790090 |
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| Summary | 2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0% |