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CAS No.: | 70298-89-4 |
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Name: | 2,2-DIMETHYL-N-PYRIDIN-4-YL-PROPIONAMIDE |
Article Data: | 30 |
Molecular Structure: | |
Formula: | C10H14N2O |
Molecular Weight: | 178.234 |
Synonyms: | 2,2-Dimethyl-N-(4-pyridinyl)propanamide;4-(Pivaloylamino)pyridine;4-(tert-Butylcarbonylamino)pyridine;N-(Pyridin-4-yl)pivalamide;NSC 206407; |
Density: | 1.078 g/cm3 |
Melting Point: | 73.9-74.0 °C |
Boiling Point: | 349.3 °C at 760 mmHg |
Flash Point: | 165.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | Xi:Irritant; "> Xi:Irritant; |
PSA: | 41.99000 |
LogP: | 2.13920 |
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The CAS register number of N-(Pyridin-4-yl)pivalamide is 70298-89-4. It also can be called as Propanamide,2,2-dimethyl-N-4-pyridinyl- and the IUPAC name about this chemical is 2,2-dimethyl-N-pyridin-4-ylpropanamide. The molecular formula about this chemical is C10H14N2O and the molecular weight is 178.23. It belongs to the following product categories which include API intermediates; Amines; Pyridines and so on.
Physical properties about N-(Pyridin-4-yl)pivalamide are: (1)ACD/LogP: 1.82; (2)ACD/LogD (pH 5.5): 0.95; (3)ACD/LogD (pH 7.4): 1.78; (4)ACD/BCF (pH 5.5): 1.93; (5)ACD/BCF (pH 7.4): 13.12; (6)ACD/KOC (pH 5.5): 31.68; (7)ACD/KOC (pH 7.4): 214.86; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 33.2Å2; (12)Index of Refraction: 1.547; (13)Molar Refractivity: 52.48 cm3; (14)Molar Volume: 165.3 cm3; (15)Polarizability: 20.8x10-24cm3; (16)Surface Tension: 41.5 dyne/cm; (17)Enthalpy of Vaporization: 59.38 kJ/mol; (18)Boiling Point: 349.3 °C at 760 mmHg; (19)Vapour Pressure: 4.73E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccncc1)C(C)(C)C
(2)InChI: InChI=1/C10H14N2O/c1-10(2,3)9(13)12-8-4-6-11-7-5-8/h4-7H,1-3H3,(H,11,12,13)
(3)InChIKey: JCMMVFHXRDNILC-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C10H14N2O/c1-10(2,3)9(13)12-8-4-6-11-7-5-8/h4-7H,1-3H3,(H,11,12,13)
(5)Std. InChIKey: JCMMVFHXRDNILC-UHFFFAOYSA-N