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(S)-Cbz-Phenylalaninol

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(S)-Cbz-Phenylalaninol

EINECS 1533716-785-6
CAS No. 6372-14-1 Density 1.175 g/cm3
PSA 58.56000 LogP 2.90730
Solubility insoluble in water Melting Point 92-95 °C
Formula C17H19NO3 Boiling Point 489 °C at 760 mmHg
Molecular Weight 285.343 Flash Point 249.6 °C
Transport Information N/A Appearance N/A
Safety 22-24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 6372-14-1 ((S)-Cbz-Phenylalaninol) Hazard Symbols N/A
Synonyms

Carbamicacid, [(1S)-1-(hydroxymethyl)-2-phenylethyl]-, phenylmethyl ester (9CI);Carbamicacid, [1-(hydroxymethyl)-2-phenylethyl]-, phenylmethyl ester, (S)-;Carbamicacid, [a-(hydroxymethyl)phenethyl]-,benzyl ester, L- (8CI);(S)-Z-Phenylalaninol;N-(Benzyloxycarbonyl)phenylalaninol;N-Benzyloxycarbonyl-L-phenylalaninol;NSC133422;Z-Phenylalaninol;Z-Phe-ol;

Article Data 74

(S)-Cbz-Phenylalaninol Specification

The Z-L-phenylalaninol, with the CAS registry number 6372-14-1, has the systematic name of benzyl [(2S)-1-hydroxy-3-phenylpropan-2-yl]carbamate. It is a kind of white powder, and it is insoluble in water. The molecular formula of this chemical is C17H19NO3. What's more, while dealing with this chemical, you should not breathe dust and then try to avoid contacting with skin and eyes.

The physical properties of Sodium potassium tartrate are as followings: (1)ACD/LogP: 3.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.25; (4)ACD/LogD (pH 7.4): 3.25; (5)ACD/BCF (pH 5.5): 174.87; (6)ACD/BCF (pH 7.4): 174.86; (7)ACD/KOC (pH 5.5): 1402.64; (8)ACD/KOC (pH 7.4): 1402.59; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 38.77 Å2; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 81.05 cm3; (15)Molar Volume: 242.6 cm3; (16)Polarizability: 32.13×10-24cm3; (17)Surface Tension: 49 dyne/cm; (18)Density: 1.175 g/cm3; (19)Flash Point: 249.6 °C; (20)Enthalpy of Vaporization: 79.55 kJ/mol; (21)Boiling Point: 489 °C at 760 mmHg; (22)Vapour Pressure: 2.23E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N[C@@H](Cc2ccccc2)CO
(2)InChI: InChI=1/C17H19NO3/c19-12-16(11-14-7-3-1-4-8-14)18-17(20)21-13-15-9-5-2-6-10-15/h1-10,16,19H,11-13H2,(H,18,20)/t16-/m0/s1
(3)InChIKey: WPOFMMJJCPZPAO-INIZCTEOBG

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