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Cas Database |
| Name |
(3R,4S)-1-Benzoyl-3-(1-ethoxyethoxy)-4-phenyl-2-azetidinone |
EINECS | N/A |
| CAS No. | 201856-53-3 | Density | 1.227 g/cm3 |
| PSA | 55.84000 | LogP | 3.11590 |
| Solubility | N/A | Melting Point |
1.22 |
| Formula | C20H21NO4 | Boiling Point | 464.832 °C at 760 mmHg |
| Molecular Weight | 339.391 | Flash Point | 234.922 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-Azetidinone,1-benzoyl-3-(1-ethoxyethoxy)-4-phenyl-, [3R-(3a,4a)]-[partial]-; |
Article Data | 3 |
(3R,4S)-1-Benzoyl-3-(1-ethoxyethoxy)-4-phenyl-2-azetidinone Chemical Properties
Systematic Name: (3R,4S)-3-(1-Ethoxyethoxy)-4-phenyl-1-(phenylcarbonyl)azetidin-2-one
Synonyms of (3R,4S)-1-Benzoyl-3-(1-ethoxyethoxy)-4-phenyl-2-azetidinone (CAS NO.201856-53-3): (3R,4S)-3-(1-Ethoxyethoxy)-4-phenyl-1-(phenylcarbonyl)azetidin-2-one
CAS NO: 201856-53-3
Molecular Formula: C20H21NO4
Molecular Weight: 339.39
Molecular Structure: 
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 6
Polar Surface Area: 55.84 Å2
Index of Refraction: 1.595
Molar Refractivity: 93.993 cm3
Molar Volume: 276.686 cm3
Surface Tension: 51.097 dyne/cm
Density: 1.227 g/cm3
Flash Point: 234.922 °C
Enthalpy of Vaporization: 72.632 kJ/mol
Boiling Point: 464.832 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
SMILES: O=C3N(C(=O)c1ccccc1)[C@@H](c2ccccc2)[C@H]3OC(OCC)C
InChI: InChI=1/C20H21NO4/c1-3-24-14(2)25-18-17(15-10-6-4-7-11-15)21(20(18)23)19(22)16-12-8-5-9-13-16/h4-14,17-18H,3H2,1-2H3/t14?,17-,18+/m0/s1
InChIKey: XSYLUBKWRZCOQP-CXRLMVSZBT
Std. InChI: InChI=1S/C20H21NO4/c1-3-24-14(2)25-18-17(15-10-6-4-7-11-15)21(20(18)23)19(22)16-12-8-5-9-13-16/h4-14,17-18H,3H2,1-2H3/t14?,17-,18+/m0/s1
Std. InChIKey: XSYLUBKWRZCOQP-CXRLMVSZSA-N
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