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CAS No.: | 868077-44-5 |
---|---|
Name: | 1-(5-Nitro-2-pyridinyl)piperidine-4-carboxylic acid |
Molecular Structure: | |
Formula: | C11H13 N3 O4 |
Molecular Weight: | 251.242 |
Synonyms: | 1-(5-NITRO-2-PYRIDINYL)PIPERIDINE-4-CARBOXYLIC ACID |
Density: | 1.403g/cm3 |
Boiling Point: | 504.9ºC at 760 mmHg |
Flash Point: | 259.2ºC |
PSA: | 99.25000 |
LogP: | 1.87900 |
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Molecular Structure of 1-(5-Nitro-2-pyridinyl)piperidine-4-carboxylic acid (CAS No.868077-44-5):
Molecular Formula: C11H13N3O4
Molecular Weight: 251.2386
CAS No: 868077-44-5
H bond acceptors: 7
H bond donors: 1
Freely Rotating Bonds: 3
Polar Surface Area: 88.25 Å2
Index of Refraction: 1.606
Molar Refractivity: 61.81 cm3
Molar Volume: 179 cm3
Surface Tension: 67.7 dyne/cm
Density: 1.403 g/cm3
Flash Point: 259.2 °C
Enthalpy of Vaporization: 81.55 kJ/mol
Boiling Point: 504.9 °C at 760 mmHg
Vapour Pressure: 5.13E-11 mmHg at 25°C
Systematic Name: 1-(5-Nitropyridin-2-yl)piperidine-4-carboxylic acid
InChI: InChI=1/C11H13N3O4/c15-11(16)8-3-5-13(6-4-8)10-2-1-9(7-12-10)14(17)18/h1-2,7-8H,3-6H2,(H,15,16)
InChIKey: RKRUADFRDLUFHR-UHFFFAOYAD
Std. InChI: InChI=1S/C11H13N3O4/c15-11(16)8-3-5-13(6-4-8)10-2-1-9(7-12-10)14(17)18/h1-2,7-8H,3-6H2,(H,15,16)
Std. InChIKey: RKRUADFRDLUFHR-UHFFFAOYSA-N
1-(5-Nitro-2-pyridinyl)piperidine-4-carboxylic acid (CAS No.868077-44-5), its synonyms are 4-Piperidinecarboxylic acid, 1-(5-nitro-2-pyridinyl)- ; 1-(5-Nitro-2-pyridinyl)-4-piperidinecarboxylic acid .