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Name |
trans-4-Phenyl-L-proline |
EINECS | 416-020-1 |
CAS No. | 96314-26-0 | Density | 1.186 g/cm3 |
PSA | 49.33000 | LogP | 1.54550 |
Solubility | N/A | Melting Point |
>300 °C (decomp) |
Formula | C11H13NO2 | Boiling Point | 372.8 °C at 760 mmHg |
Molecular Weight | 191.23 | Flash Point | 179.3 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 22-36/37 | Risk Codes | 43-62 |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
L-Proline,4-phenyl-, trans-;Proline, 4-phenyl- (6CI);trans-4-Phenyl-L-proline; |
Article Data | 3 |
The trans-4-Phenyl-L-proline ,its cas register number is 96314-26-0.It also can be called as (4S)-4-Phenyl-L-proline and the Systematic name about this chemical is 4-Phenyl-L-proline .
The trans-4-Phenyl-L-proline is a dangerous chemical, because it may cause sensitization by skin contact and it has risk of impaired fertility. In the using process, you need to wear suitable protective clothing and gloves and do not breathe dust.
Following are the chemical properties about trans-4-Phenyl-L-proline :(1)#H bond acceptors: 3 ; (2)#H bond donors: 2 ; (3)#Freely Rotating Bonds: 2 ; (4)Polar Surface Area: 29.54Å2 ; (5)Index of Refraction: 1.562 ; (6)Molar Refractivity: 52.34 cm3 ; (7)Molar Volume: 161.1 cm3 ; (8)Polarizability: 20.75x10-24cm3 ; (9)Surface Tension: 46.4 dyne/cm; (10)Enthalpy of Vaporization: 65.4 kJ/mol ; (11)Vapour Pressure: 3.22E-06 mmHg at 25°C
This chemical can be described computed from structure:
(1)SMILES: O=C(O)[C@H]2NCC(c1ccccc1)C2
(2)InChI: InChI=1/C11H13NO2/c13-11(14)10-6-9(7-12-10)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7H2,(H,13,14)/t9?,10-/m0/s1
(3)InChIKey: JHHOFXBPLJDHOR-AXDSSHIGBF
(4)Std. InChI: InChI=1S/C11H13NO2/c13-11(14)10-6-9(7-12-10)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7H2,(H,13,14)/t9?,10-/m0/s1
(5)Std. InChIKey: JHHOFXBPLJDHOR-AXDSSHIGSA-N