-
Name
(2R,4R)-N-Boc-4-hydroxypyrrolidine-2-carboxylic acid
- EINECS 621-971-2
- CAS No. 135042-12-5
- Article Data27
- CAS DataBase
- Density 1.312 g/cm3
- Solubility
- Melting Point 145 °C
- Formula C10H17NO5
- Boiling Point 390.9 °C at 760 mmHg
- Molecular Weight 231.249
- Flash Point 190.2 °C
- Transport Information
- Appearance
- Safety 26
- Risk Codes 36
-
Molecular Structure
- Hazard Symbols Xi
- Synonyms 1,2-Pyrrolidinedicarboxylicacid, 4-hydroxy-, 1-(1,1-dimethylethyl) ester, (2R-cis)-;(2R,4R)-1-(tert-Butoxycarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid;(2R,4R)-1-tert-Butoxycarbonyl-4-hydroxypyrrolidine-2-carboxylic acid;(2R,4R)-4-Hydroxypyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester;
- PSA
- LogP
(2R,4R)-N-Boc-4-hydroxypyrrolidine-2-carboxylic acid Chemical Properties
Systematic Name: (4R)-1-(tert-butoxycarbonyl)-4-hydroxy-D-proline
Synonyms of (2R,4R)-N-Boc-4-hydroxypyrrolidine-2-carboxylic acid (CAS NO.135042-12-5): (2R,4R)-1-tert-Butoxycarbonyl-4-hydroxypyrrolidine-2-carboxylic acid ; (2R,4R)-4-Hydroxypyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester
CAS NO: 135042-12-5
Molecular Formula: C10H17NO5
Molecular Weight: 231.25
Molecular Structure: 
H bond acceptors: 6
H bond donors: 2
Freely Rotating Bonds: 4
Polar Surface Area: 65.07 Å2
Index of Refraction: 1.531
Molar Refractivity: 54.52 cm3
Molar Volume: 176.1 cm3
Surface Tension: 57 dyne/cm
Density: 1.312 g/cm3
Flash Point: 190.2 °C
Enthalpy of Vaporization: 74.05 kJ/mol
Boiling Point: 390.9 °C at 760 mmHg
Vapour Pressure: 9.99E-08 mmHg at 25°C
Melting Point: 145°C
SMILES: O=C(OC(C)(C)C)N1[C@@H](C(=O)O)C[C@@H](O)C1
InChI: InChI=1/C10H17NO5/c1-10(2,3)16-9(15)11-5-6(12)4-7(11)8(13)14/h6-7,12H,4-5H2,1-3H3,(H,13,14)/t6-,7-/m1/s1
InChIKey: BENKAPCDIOILGV-RNFRBKRXBV
Std. InChI: InChI=1S/C10H17NO5/c1-10(2,3)16-9(15)11-5-6(12)4-7(11)8(13)14/h6-7,12H,4-5H2,1-3H3,(H,13,14)/t6-,7-/m1/s1
Std. InChIKey: BENKAPCDIOILGV-RNFRBKRXSA-N
(2R,4R)-N-Boc-4-hydroxypyrrolidine-2-carboxylic acid Safety Profile
HazardClass: IRRITANT
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