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CAS No.: | 180869-39-0 |
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Name: | 4-Pyrimidinecarboxaldehyde, 2-(methylamino)- (9CI) |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C6H7N3O |
Molecular Weight: | 137.14 |
Synonyms: | 2-methylamino-4-pyrimidine carboxaldehyde;ZLD0310;2-N-Methylaminopyrimidine-4-carboxaldehyde;2-(Methylamino)pyrimidine-4-carbaldehyde;2-methylamino-pyrimidine-4-carbaldehyde; |
Density: | 1.281 g/cm3 |
Boiling Point: | 305.4 °C at 760 mmHg |
Flash Point: | 138.5 °C |
PSA: | 54.88000 |
LogP: | 0.40380 |
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This chemical is called 2-(Methylamino)pyrimidine-4-carboxaldehyde, and its CAS registry number is 137.14. With the molecular formula of C6H7N3O, its molecular weight is 137.14. Additionally, its product category is Pyrimidine.
Other characteristics of the 2-(Methylamino)pyrimidine-4-carboxaldehyde can be summarised as followings: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 15.16; (4)ACD/KOC (pH 7.4): 15.17; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 54.88 Å2; (9)Index of Refraction: 1.645; (10)Molar Refractivity: 38.79 cm3; (11)Molar Volume: 107 cm3; (14)Polarizability: 15.38×10-24cm3; (13)Surface Tension: 61.3 dyne/cm; (14)Density: 1.281 g/cm3; (15)Flash Point: 138.5 °C; (16)Enthalpy of Vaporization: 54.58 kJ/mol; (17)Boiling Point: 305.4 °C at 760 mmHg; (18)Vapour Pressure: 0.000825 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CNc1nc(C=O)ccn1
2.InChI: InChI=1/C6H7N3O/c1-7-6-8-3-2-5(4-10)9-6/h2-4H,1H3,(H,7,8,9)
3.InChIKey: HGTHYMOKILRDHL-UHFFFAOYAH