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Basic Information
CAS No.: 596793-30-5
Name: (3S,4S)-N-Cbz-3,4-dihydroxypyrrolidine
Article Data: 7
Molecular Structure:
Molecular Structure of 596793-30-5 ((3S,4S)-N-Cbz-3,4-dihydroxypyrrolidine)
Formula: C12H15 N O4
Molecular Weight: 237.255
Synonyms: (3S,4S)-Benzyl 3,4-dihydroxypyrrolidine-1-carboxylate; (3S,4S)-3,4-Dihydroxy-1-pyrrolidinecarboxylic acid phenylmethyl ester
Density: 1.378
PSA: 70.00000
LogP: 0.29850
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Chemistry

Molecular Structure of (3S,4S)-N-Cbz-3,4-dihydroxypyrrolidine (CAS No.596793-30-5):
 
Molecular Formula: C12H15NO4
Molecular Weight: 237.25
CAS No: 596793-30-5
H bond acceptors: 5
H bond donors: 2
Freely Rotating Bonds: 5
Polar Surface Area: 70 Å2
Index of Refraction: 1.622
Molar Refractivity: 60.63 cm3
Molar Volume: 172 cm3
Surface Tension: 69.2 dyne/cm
Density: 1.378 g/cm3
Flash Point: 194.1 °C
Enthalpy of Vaporization: 68.32 kJ/mol
Boiling Point: 397.4 °C at 760 mmHg
Vapour Pressure: 5E-07 mmHg at 25°C
InChI: InChI=1/C12H15NO4/c14-10-6-13(7-11(10)15)12(16)17-8-9-4-2-1-3-5-9/h1-5,10-11,14-15H,6-8H2/t10-,11-/m0/s1
InChIKey: OSDPRBVIIIGHPO-QWRGUYRKBZ
Std. InChI: InChI=1S/C12H15NO4/c14-10-6-13(7-11(10)15)12(16)17-8-9-4-2-1-3-5-9/h1-5,10-11,14-15H,6-8H2/t10-,11-/m0/s1
Std. InChIKey: OSDPRBVIIIGHPO-QWRGUYRKSA-N
Synonyms of (3S,4S)-N-Cbz-3,4-dihydroxypyrrolidine (CAS No.596793-30-5): (3s,4s)-N-cbz-3,4-dihydroxypyrrolidine ; (3S,4S)-3,4-Dihydroxy-1-pyrrolidinecarboxylic acid phenylmethyl ester ; (3S,4S)-Benzyl 3,4-dihydroxypyrrolidine-1-carboxylate