tert-Butyl (1-hydroxy-3-phenylpropan-2-yl)carbamate supplier

Name
N-BOC-D/L-PHENYLALANINOL
EINECS
CAS No. 145149-48-0
Article Data16
CAS DataBase
Density 1.085 g/cm³
Solubility
Melting Point 85.0 to 90.0 °C
Formula C₁₄H₂₁NO₃
Boiling Point 410.1 °C at 760 mmHg
Molecular Weight 251.326
Flash Point 201.8 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbamicacid, [1-(hydroxymethyl)-2-phenylethyl]-, 1,1-dimethylethyl ester (9CI);N-tert-Butoxycarbonyl-DL-phenylalaninol;
PSA 58.56000
LogP 2.50560

tert-Butyl (1-hydroxy-3-phenylpropan-2-yl)carbamate Specification

This chemical is called tert-Butyl (1-hydroxy-3-phenylpropan-2-yl)carbamate, and its CAS registry number is 145149-48-0. With the molecular formula of C₁₄H₂₁NO₃, its molecular weight is 251.32. When you use this chemical, please avoid contacting with skin and eyes.

Other characteristics of the tert-Butyl (1-hydroxy-3-phenylpropan-2-yl)carbamate can be summarised as followings: (1)ACD/LogP: 2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.64; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 59.79; (6)ACD/BCF (pH 7.4): 59.79; (7)ACD/KOC (pH 5.5): 650.61; (8)ACD/KOC (pH 7.4): 650.59; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 38.77 Å²; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 70.42 cm³; (15)Molar Volume: 231.5 cm³; (16)Polarizability: 27.91×10^-24cm³; (17)Surface Tension: 40.6 dyne/cm; (18)Density: 1.085 g/cm³; (19)Flash Point: 201.8 °C; (20)Enthalpy of Vaporization: 69.84 kJ/mol; (21)Boiling Point: 410.1 °C at 760 mmHg; (22)Vapour Pressure: 1.84E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC(C)(C)C)NC(Cc1ccccc1)CO
2.InChI: InChI=1/C14H21NO3/c1-14(2,3)18-13(17)15-12(10-16)9-11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3,(H,15,17)
3.InChIKey: LDKDMDVMMCXTMO-UHFFFAOYAO

Product Name

N-BOC-D/L-PHENYLALANINOL

tert-Butyl (1-hydroxy-3-phenylpropan-2-yl)carbamate Specification

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