Name: Pyrimidine, 5-methoxy- (6CI,7CI,8CI,9CI)
SKU: 31458-33-0

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Basic Information

Molecular Structure:
CAS No.:	31458-33-0
Name:	Pyrimidine, 5-methoxy- (6CI,7CI,8CI,9CI)
Article Data:	16

Formula:	C₅H₆N₂O
Molecular Weight:	110.115
Synonyms:	5-Methoxypyrimidine;
Density:	1.102 g/cm³
Melting Point:	46-47℃
Boiling Point:	181.7 °C at 760 mmHg
Flash Point:	64.4 °C
PSA:	35.01000
LogP:	0.48520

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Specification

The Pyrimidine, 5-methoxy- is an organic compound with the formula C₅H₆N₂O. The systematic name of this chemical is 5-methoxypyrimidine. With the CAS registry number 31458-33-0, it is also named as methyl5-pyrimidinylether.

Physical properties about Pyrimidine, 5-methoxy- are: (1)ACD/LogP: 0.05; (2)ACD/LogD (pH 5.5): 0.05; (3)ACD/LogD (pH 7.4): 0.05; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 25.34; (7)ACD/KOC (pH 7.4): 25.34; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 35.01 Å²; (11)Index of Refraction: 1.494; (12)Molar Refractivity: 29.11 cm³; (13)Molar Volume: 99.8 cm³; (14)Polarizability: 11.54×10^-24cm³; (15)Surface Tension: 40.6 dyne/cm; (16)Density: 1.102 g/cm³; (17)Flash Point: 64.4 °C; (18)Enthalpy of Vaporization: 40.08 kJ/mol; (19)Boiling Point: 181.7 °C at 760 mmHg; (20)Vapour Pressure: 1.15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cncnc1)C
(2)InChI: InChI=1/C5H6N2O/c1-8-5-2-6-4-7-3-5/h2-4H,1H3
(3)InChIKey: JIADELSANNMYFC-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C5H6N2O/c1-8-5-2-6-4-7-3-5/h2-4H,1H3
(5)Std. InChIKey: JIADELSANNMYFC-UHFFFAOYSA-N