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CAS No.: | 37784-17-1 |
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Name: | N-Boc-D-proline |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C10H17NO4 |
Molecular Weight: | 215.249 |
Synonyms: | N-tert-Butoxycarbonyl-D-proline; |
EINECS: | 1533716-785-6 |
Density: | 1.201 g/cm3 |
Melting Point: | 134-137 °C(lit.) |
Boiling Point: | 337.2 °C at 760 mmHg |
Flash Point: | 157.7 °C |
Appearance: | white to off-white microcrystalline powder |
Safety: | 24/25 |
PSA: | 66.84000 |
LogP: | 1.40840 |
The Boc-D-Proline , with cas registry number of 37784-17-1, is white to off-white microcrystalline powder. Its BRN registry number is 479316. This chemical belongs to classes of (1)Protected Amino Acids; (2)Pyrrole&Pyrrolidine&Pyrroline; (3)Amino Acids; (4)Proline [Pro, P]; (5)Boc-Amino Acids and Derivative; (6)Amino Acids (N-Protected); (7)Biochemistry; (8)Boc-Amino Acids; (9)Boc-Amino acid series. Its IUPAC name is called (2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid . And its systematic name is called 1-(tert-butoxycarbonyl)-D-proline .
Physical properties about this chemical are: (1) ACD/LogP: 0.56 ; (2) # of Rule of 5 Violations: 0 ; (3) ACD/BCF (pH 5.5): 1 ; (4) ACD/BCF (pH 7.4): 1 ; (5) ACD/KOC (pH 5.5): 1.52 ; (6) ACD/KOC (pH 7.4): 1 ; (7) #H bond acceptors: 5 ; (8) #H bond donors: 1 ; (9) #Freely Rotating Bonds: 3 ; (10) Index of Refraction: 1.502 ; (11) Molar Refractivity: 52.93 cm3 ; (12) Molar Volume: 179.2 cm3 ; (13) Surface Tension: 47 dyne/cm ; (14) Density: 1.201 g/cm3 ; (15) Flash Point: 157.7 °C ; (16) Enthalpy of Vaporization: 63.79 kJ/mol ; (17) Boiling Point: 337.2 °C at 760 mmHg ; (18) Vapour Pressure: 2E-05 mmHg at 25°C; (19) Alpha: 60 o (c=2, acetic acid); (20) Refractive index: 60 ° (C=2, AcOH).
When you are using this chemical, please be cautious about it as the following:
This material may cause irritation to skin and eyes. So, avoid contact with skin and eyes. After use it, store it at temperature of -20°C.
In addition, you could convert the following data information into the molecular structure:
(1) SMILES:O=C(OC(C)(C)C)N1[C@@H](C(=O)O)CCC1;
(2) InChI:InChI=1/C10H17NO4/c1-10(2,3)15-9(14)11-6-4-5-7(11)8(12)13/h7H,4-6H2,1-3H3,(H,12,13)/t7-/m1/s1;
(3) InChIKey:ZQEBQGAAWMOMAI-SSDOTTSWBN