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Name |
7-Bromotryptophan |
EINECS | N/A |
CAS No. | 852391-45-8 | Density | 1.705 g/cm3 |
PSA | 79.11000 | LogP | 2.58510 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H11BrN2O2 | Boiling Point | 495.849 °C at 760 mmHg |
Molecular Weight | 283.125 | Flash Point | 253.68 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
7-Bromotryptophan; |
Article Data | 3 |
The CAS register number of 7-Bromotryptophan is 852391-45-8. It also can be called as Tryptophan, 7-bromo- and the systematic name about this chemical is 7-bromotryptophan. The molecular formula about this chemical is C11H11BrN2O2 and molecular weight is 283.12.
Physical properties about 7-Bromotryptophan are: (1)ACD/LogP: 1.46; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 79.11Å2; (10)Index of Refraction: 1.718; (11)Molar Refractivity: 65.459 cm3; (12)Molar Volume: 166.06 cm3; (13)Polarizability: 25.95x10-24cm3; (14)Surface Tension: 73.243 dyne/cm; (15)Enthalpy of Vaporization: 80.405 kJ/mol; (16)Boiling Point: 495.849 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)C(N)Cc2cnc1c(Br)cccc12
(2)InChI: InChI=1/C11H11BrN2O2/c12-8-3-1-2-7-6(5-14-10(7)8)4-9(13)11(15)16/h1-3,5,9,14H,4,13H2,(H,15,16)
(3)InChIKey: VMMOOBBCGTVDGP-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C11H11BrN2O2/c12-8-3-1-2-7-6(5-14-10(7)8)4-9(13)11(15)16/h1-3,5,9,14H,4,13H2,(H,15,16)
(5)Std. InChIKey: VMMOOBBCGTVDGP-UHFFFAOYSA-N