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7-Bromo-L-tryptophan

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Name

7-Bromo-L-tryptophan

EINECS N/A
CAS No. 75816-19-2 Density 1.704 g/cm3
PSA 79.11000 LogP 2.58510
Solubility N/A Melting Point N/A
Formula C11H11BrN2O2 Boiling Point 495.8 °C at 760 mmHg
Molecular Weight 283.125 Flash Point 253.7 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 75816-19-2 (7-Bromo-L-tryptophan) Hazard Symbols N/A
Synonyms

7-BROMO-L-TRYPTOPHAN

Article Data 16

7-Bromo-L-tryptophan Specification

The cas register number of 7-Bromo-L-tryptophan is 75816-19-2. The Systematic name about this chemical is 5-bromotryptophan.

Physical properties about 7-Bromo-L-tryptophan are: (1)ACD/LogP: 1.90; (2)ACD/LogD (pH 5.5): -0.6; (3)ACD/LogD (pH 7.4): -0.61; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 34.47Å2; (12)Index of Refraction: 1.718; (13)Molar Refractivity: 65.45 cm3; (14)Molar Volume: 166 cm3; (15)Polarizability: 25.95x10-24cm3; (16)Surface Tension: 73.2 dyne/cm; (17)Enthalpy of Vaporization: 80.41 kJ/mol; (18)Vapour Pressure: 1.19E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(N)Cc2c1cc(Br)ccc1nc2
(2)InChI: InChI=1/C11H11BrN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)
(3)InChIKey: KZDNJQUJBMDHJW-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C11H11BrN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)
(5)Std. InChIKey: KZDNJQUJBMDHJW-UHFFFAOYSA-N

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