CAS No.220114-83-0,2-Pyrimidinecarboxaldehyde, 5-methoxy- (9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	220114-83-0
Name:	2-Pyrimidinecarboxaldehyde, 5-methoxy- (9CI)

Formula:	C₆H₆N₂O₂
Molecular Weight:	138.126
Synonyms:	2-Pyrimidinecarboxaldehyde, 5-methoxy- (9CI);5-Methoxy-2-pyrimidinecarboxaldehyde;5-MethoxypyriMidine-2-carbaldehyde;2-PyriMidinecarboxaldehyde, 5-Methoxy-
Density:	1.238 g/cm³
Boiling Point:	308.3 °C at 760 mmHg
Flash Point:	140.3 °C
PSA:	52.08000
LogP:	0.29770

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Specification

The 2-Pyrimidinecarboxaldehyde,5-methoxy- is an organic compound with the formula C₆H₆N₂O₂. The systematic name of this chemical is 5-Methoxypyrimidine-2-carbaldehyde. With the CAS registry number 220114-83-0, it is also named as 5-Methoxy-2-pyrimidinecarbaldehyde. The category of the product is Pyrimidine. Besides, its molecular weight is 138.12404.

The physical properties of 2-Pyrimidinecarboxaldehyde,5-methoxy- are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 10.72; (4)ACD/KOC (pH 7.4): 10.72; (5)#H bond acceptors: 4; (6)#Freely Rotating Bonds: 2; (7)Polar Surface Area: 52.08 Å²; (8)Index of Refraction: 1.556; (9)Molar Refractivity: 35.86 cm³; (10)Molar Volume: 111.5 cm³; (11)Polarizability: 14.21×10^-24 cm³; (12)Surface Tension: 50.4 dyne/cm; (13)Density: 1.238 g/cm³; (14)Flash Point: 140.3 °C; (15)Enthalpy of Vaporization: 52.71 kJ/mol; (16)Boiling Point: 308.3 °C at 760 mmHg; (17)Vapour Pressure: 0.00125 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1ncc(OC)cn1
(2)InChI: InChI=1/C6H6N2O2/c1-10-5-2-7-6(4-9)8-3-5/h2-4H,1H3
(3)InChIKey: YWCAULDHVOEECI-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C6H6N2O2/c1-10-5-2-7-6(4-9)8-3-5/h2-4H,1H3
(5)Std. InChIKey: YWCAULDHVOEECI-UHFFFAOYSA-N