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L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-2-propen-1-yl-

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Name

L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-2-propen-1-yl-

EINECS N/A
CAS No. 127132-38-1 Density 1.145 g/cm3
PSA 84.86000 LogP 3.16270
Solubility N/A Melting Point N/A
Formula C17H23NO5 Boiling Point 490.39 °C at 760 mmHg
Molecular Weight 321.373 Flash Point 250.379 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 127132-38-1 (BOC-L-TYR(ALL)-OH) Hazard Symbols N/A
Synonyms

L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-2-propenyl- (9CI);

Article Data 10

L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-2-propen-1-yl- Specification

The L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-2-propen-1-yl- is an organic compound with the formula C17H23NO5. The systematic name of this chemical is N-(tert-butoxycarbonyl)-O-prop-2-en-1-yl-L-tyrosine. With the CAS registry number 127132-38-1, it is also named as O-allyl-N-(tert-butoxycarbonyl)-L-tyrosine. Besides, it should be stored at temperature of 2-8°C.

Physical properties about L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-2-propen-1-yl- are: (1)ACD/LogP: 1.94; (2)ACD/LogD (pH 5.5): 2; (3)ACD/BCF (pH 5.5): 4; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 23; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 6; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 9; (10)Polar Surface Area: 84.86 Å2; (11)Index of Refraction: 1.526; (12)Molar Refractivity: 86.127 cm3; (13)Molar Volume: 280.749 cm3; (14)Polarizability: 34.144×10-24cm3; (15)Surface Tension: 42.017 dyne/cm; (16)Density: 1.145 g/cm3; (17)Flash Point: 250.379 °C; (18)Enthalpy of Vaporization: 79.718 kJ/mol; (19)Boiling Point: 490.39 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccc(OC/C=C)cc1
(2)InChI: InChI=1/C17H23NO5/c1-5-10-22-13-8-6-12(7-9-13)11-14(15(19)20)18-16(21)23-17(2,3)4/h5-9,14H,1,10-11H2,2-4H3,(H,18,21)(H,19,20)/t14-/m0/s1
(3)InChIKey: YIRRNENSHUFZBH-AWEZNQCLBI
(4)Std. InChI: InChI=1S/C17H23NO5/c1-5-10-22-13-8-6-12(7-9-13)11-14(15(19)20)18-16(21)23-17(2,3)4/h5-9,14H,1,10-11H2,2-4H3,(H,18,21)(H,19,20)/t14-/m0/s1
(5)Std. InChIKey: YIRRNENSHUFZBH-AWEZNQCLSA-N

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