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CAS No.: | 64194-58-7 |
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Name: | 6-AMINO-5-FORMYLAMINO-3H-PYRIMIDINE-4-ONE |
Molecular Structure: | |
Formula: | C5H6N4O2 |
Molecular Weight: | 154.128 |
Synonyms: | 6-Amino-5-formylamino-3H-pyrimidine-4-one; |
Density: | 1.71 g/cm3 |
Boiling Point: | 346.4 °C at 760 mmHg |
Flash Point: | 163.3 °C |
PSA: | 101.13000 |
LogP: | 0.62280 |
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The N-(4-Amino-6-oxo-3H-pyrimidin-5-yl)formamide, with the CAS registry number 64194-58-7, is also known as 6-Amino-5-formylamino-3H-pyrimidine-4-one. It belongs to the product categories of Heterocyclic Compounds; Heterocycles. This chemical's molecular formula is C5H6N4O2 and molecular weight is 154.13. What's more, its systematic name is N-(6-amino-4-oxo-1,4-dihydropyrimidin-5-yl)formamide.
Physical properties of N-(4-Amino-6-oxo-3H-pyrimidin-5-yl)formamide are: (1)ACD/LogP: -3.48; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 56.22 Å2; (7)Index of Refraction: 1.728; (8)Molar Refractivity: 35.81 cm3; (9)Molar Volume: 89.9 cm3; (10)Polarizability: 14.19×10-24cm3; (11)Surface Tension: 81.7 dyne/cm; (12)Density: 1.71 g/cm3; (13)Flash Point: 163.3 °C; (14)Enthalpy of Vaporization: 59.05 kJ/mol; (15)Boiling Point: 346.4 °C at 760 mmHg; (16)Vapour Pressure: 5.78E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1/N=C\N\C(=C1\NC=O)N
(2)Std. InChI: InChI=1S/C5H6N4O2/c6-4-3(9-2-10)5(11)8-1-7-4/h1-2H,(H,9,10)(H3,6,7,8,11)
(3)Std. InChIKey: ISOPYSSRZGKNQL-UHFFFAOYSA-N