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CAS No.: | 24182-11-4 |
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Name: | (R)-PIPERAZINE-2-CARBOXYLIC ACID |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C5H10N2O2 |
Molecular Weight: | 130.147 |
Synonyms: | 3-Pyridazinecarboxylicacid, hexahydro-, (R)- (8CI);(R)-Piperazine-3-carboxylic acid; |
Density: | 1.175 g/cm3 |
Boiling Point: | 313.622 °C at 760 mmHg |
Flash Point: | 143.474 °C |
Appearance: | White or light yellow crystalline powder |
PSA: | 61.36000 |
LogP: | -0.71000 |
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The Piperidazine-3-(R)-carboxylic acid, with the CAS registry number 24182-11-4, is also known as 3-Pyridazinecarboxylicacid, hexahydro-, (3R)-. This chemical's molecular formula is C5H10N2O2 and molecular weight is 130.15. What's more, its systematic name is (R)-Piperazine-3-carboxylic acid. It is a kind of white or light yellow crystalline powder in appearance. The product should be sealed and stored in containers with dry inert gas.
Physical properties of Piperidazine-3-(R)-carboxylic acid are: (1)ACD/LogP: -0.931; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.81; (4)ACD/LogD (pH 7.4): -3.44; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 61.36 Å2; (13)Index of Refraction: 1.476; (14)Molar Refractivity: 31.25 cm3; (15)Molar Volume: 110.769 cm3; (16)Polarizability: 12.389×10-24cm3; (17)Surface Tension: 39.3 dyne/cm; (18)Density: 1.175 g/cm3; (19)Flash Point: 143.474 °C; (20)Enthalpy of Vaporization: 60.999 kJ/mol; (21)Boiling Point: 313.622 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H]1NCCNC1
(2)Std. InChI: InChI=1S/C5H10N2O2/c8-5(9)4-3-6-1-2-7-4/h4,6-7H,1-3H2,(H,8,9)/t4-/m1/s1
(3)Std. InChIKey: JSSXHAMIXJGYCS-SCSAIBSYSA-N