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D-Tyrosine,O-(1,1-dimethylethyl)- (186698-58-8)

Identification
Name:D-Tyrosine,O-(1,1-dimethylethyl)-
Synonyms:H-D-Tyr(tBu)-OH;
CAS:186698-58-8
Molecular Formula: C13H19NO3
Molecular Weight: 237.29
InChI: InChI=1/C13H19NO3/c1-13(2,3)17-10-6-4-9(5-7-10)8-11(14)12(15)16/h4-7,11H,8,14H2,1-3H3,(H,15,16)/t11-/m1/s1
Molecular Structure: (C13H19NO3) H-D-Tyr(tBu)-OH;
Properties
Flash Point: 180.3°C
Boiling Point: 374.5°C at 760 mmHg
Density:1.124
Refractive index:1.538
Specification:

The D-Tyrosine,O-(1,1-dimethylethyl)-, with CAS registry number 186698-58-8, belongs to the following product categories: (1)Amino Acids; (2)Amino Acids and Derivatives; (3)Amino Acid Derivatives. It has the systematic name of (2R)-2-ammonio-3-(4-tert-butoxyphenyl)propanoate. This chemical should be stored at the temperature of 2-8°C.

Physical properties of D-Tyrosine,O-(1,1-dimethylethyl)-: (1)ACD/LogP: 2.26; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 46.53 Å2; (7)Index of Refraction: 1.538; (8)Molar Refractivity: 66.03 cm3; (9)Molar Volume: 211 cm3; (10)Polarizability: 26.17×10-24cm3; (11)Surface Tension: 43.8 dyne/cm; (12)Enthalpy of Vaporization: 65.61 kJ/mol; (13)Vapour Pressure: 2.83E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]C(=O)[C@H]([NH3+])Cc1ccc(OC(C)(C)C)cc1
(2)InChI: InChI=1/C13H19NO3/c1-13(2,3)17-10-6-4-9(5-7-10)8-11(14)12(15)16/h4-7,11H,8,14H2,1-3H3,(H,15,16)/t11-/m1/s1
(3)InChIKey: SNZIFNXFAFKRKT-LLVKDONJBJ
(4)Std. InChI: InChI=1S/C13H19NO3/c1-13(2,3)17-10-6-4-9(5-7-10)8-11(14)12(15)16/h4-7,11H,8,14H2,1-3H3,(H,15,16)/t11-/m1/s1
(5)Std. InChIKey: SNZIFNXFAFKRKT-LLVKDONJSA-N

Flash Point: 180.3°C
Storage Temperature: 2-8°C
Safety Data