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| CAS No.: | 59760-04-2 |
|---|---|
| Name: | H-HIS-PRO-NH2 2 HBR |
| Molecular Structure: | |
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| Formula: | C11H17N5O2.2(HBr) |
| Molecular Weight: | 413.112 |
| Synonyms: | H-HIS-PRO-NH2 2 HBR;(L)-histidine-(L)-prolineamide dihydrobromide;H-His-Pro-NH2 · 2 HBr; |
| Boiling Point: | 677.7 °C at 760 mmHg |
| Flash Point: | 363.6 °C |
| PSA: | 118.10000 |
| LogP: | 2.01050 |
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Specification
The L-Histidyl-L-prolinamide dihydrobromide, with the CAS registry number 59760-04-2, is also known as H-His-Pro-NH2-2HBr. This chemical's molecular formula is C11H17N5O2.2HBr and molecular weight is 413.11. Its systematic name is called L-histidyl-L-prolinamide dihydrobromide.
Physical properties of L-Histidyl-L-prolinamide dihydrobromide: (1)# of Rule of 5 Violations: 1; (2)#H bond acceptors: 7; (3)#H bond donors: 5; (4)#Freely Rotating Bonds: 5; (5)Flash Point: 363.6 °C; (6)Enthalpy of Vaporization: 102.34 kJ/mol; (7)Boiling Point: 677.7 °C at 760 mmHg; (8)Vapour Pressure: 7.82E-19 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N[C@@H](Cc1cncn1)C(=O)N2CCC[C@H]2C(N)=O.Br.Br
(2)InChI: InChI=1/C11H17N5O2.2BrH/c12-8(4-7-5-14-6-15-7)11(18)16-3-1-2-9(16)10(13)17;;/h5-6,8-9H,1-4,12H2,(H2,13,17)(H,14,15);2*1H/t8-,9-;;/m0../s1
(3)InChIKey: VEUXRROWTMGTCK-CDEWPDHBBB