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CAS No.: | 52386-29-5 |
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Name: | 6-AMINO-2-METHOXY-4(1H)-PYRIMIDINONE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C5H7N3O2 |
Molecular Weight: | 141.129 |
Synonyms: | 4(1H)-Pyrimidinone,6-amino-2-methoxy- (9CI);6-Amino-2-methoxy-3,4-dihydropyrimidin-4-one;6-Amino-2-methoxy-4-pyrimidone; |
Density: | 1.51 g/cm3 |
Melting Point: | 214-216℃ |
Boiling Point: | 226.8 °C at 760 mmHg |
Flash Point: | 91 °C |
PSA: | 81.26000 |
LogP: | 0.35420 |
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The CAS register number of 4(3H)-Pyrimidinone,6-amino-2-methoxy- is 52386-29-5. It also can be called as 6-Amino-2-methoxy-4-pyrimidone and the systematic name about this chemical is 6-amino-2-methoxypyrimidin-4(1H)-one. The molecular formula about this chemical is C5H7N3O2 and the molecular weight is 141.13. It belongs to the following product categorie which include Pyrimidine.
Physical properties about 4(3H)-Pyrimidinone,6-amino-2-methoxy- are: (1)ACD/LogP: -0.99; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 6.92; (5)ACD/KOC (pH 7.4): 6.9; (6)#H bond acceptors: 5; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 45.14 Å2; (10)Index of Refraction: 1.626; (11)Molar Refractivity: 33.11 cm3; (12)Molar Volume: 93.4 cm3; (13)Polarizability: 13.12x10-24cm3; (14)Surface Tension: 56.8 dyne/cm; (15)Density: 1.51 g/cm3; (16)Flash Point: 91 °C; (17)Enthalpy of Vaporization: 46.34 kJ/mol; (18)Boiling Point: 226.8 °C at 760 mmHg; (19)Vapour Pressure: 0.0801 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C/1/N=C(/OC)NC(\N)=C\1
(2)InChI: InChI=1/C5H7N3O2/c1-10-5-7-3(6)2-4(9)8-5/h2H,1H3,(H3,6,7,8,9)
(3)InChIKey: YRLXSZNYIJKRDL-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C5H7N3O2/c1-10-5-7-3(6)2-4(9)8-5/h2H,1H3,(H3,6,7,8,9)
(5)Std. InChIKey: YRLXSZNYIJKRDL-UHFFFAOYSA-N