866186-68-7
866186-68-7 structure
- Name: (3R,4R,4aS,5R)-6-[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-3,5-dimethyl-1-oxo-3,4,4a,5-tetrahydropyrrolo[1,2-c][1,3]oxazine-4,7-dicarboxylic acid
- Chemical Name: (3R,4R,4aS,5R)-6-[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-3,5-dimethyl-1-oxo-3,4,4a,5-tetrahydropyrrolo[1,2-c][1,3]oxazine-4,7-dicarboxylic acid
- CAS Number: 866186-68-7
- Molecular Formula: C23H25N3O9S
- Molecular Weight: 519.524
- Create Date: 2017-07-07 13:13:25
- Modify Date: 2025-09-02 17:51:17
| Name | (3R,4R,4aS,5R)-6-[(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-3,5-dimethyl-1-oxo-3,4,4a,5-tetrahydropyrrolo[1,2-c][1,3]oxazine-4,7-dicarboxylic acid |
|---|---|
| Synonyms |
(3R,4R,4aS,5R)-6-({(3S,5S)-5-[(3-Carboxyphenyl)carbamoyl]-3-pyrrolidinyl}sulfanyl)-3,5-dimethyl-1-oxo-3,4,4a,5-tetrahydropyrrolo[1,2-c][1,3]oxazine-4,7-dicarboxylic acid
1H-Pyrrolo[1,2-c][1,3]oxazine-4,7-dicarboxylic acid, 6-[[(3S,5S)-5-[[(3-carboxyphenyl)amino]carbonyl]-3-pyrrolidinyl]thio]-3,4,4a,5-tetrahydro-3,5-dimethyl-1-oxo-, (3R,4R,4aS,5R)- |
| Density | 1.6±0.1 g/cm3 |
|---|---|
| Boiling Point | 831.5±65.0 °C at 760 mmHg |
| Molecular Formula | C23H25N3O9S |
| Molecular Weight | 519.524 |
| Flash Point | 456.7±34.3 °C |
| Exact Mass | 519.131165 |
| PSA | 211.36000 |
| LogP | 1.35 |
| Vapour Pressure | 0.0±3.2 mmHg at 25°C |
| Index of Refraction | 1.694 |