CAS No.114072-02-5,2-Pyrimidineethanol (9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	114072-02-5
Name:	2-Pyrimidineethanol (9CI)

Formula:	C₆H₈N₂O
Molecular Weight:	124.142
Synonyms:	2-Pyrimidin-2-ylethanol;
Density:	1.169 g/cm³
Boiling Point:	89.866 °C
Flash Point:	224.981 °C at 760 mmHg
PSA:	46.01000
LogP:	0.01140

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Specification

The 2-Pyrimidineethanol, with the CAS registry number 114072-02-5, is also known as 2-(2-Pyrimidinyl)ethanol. It belongs to the product category of Pyrimidine. This chemical's molecular formula is C₆H₈N₂O and molecular weight is 124.14. What's more, its systematic name is called 2-Pyrimidin-2-ylethanol.

Physical properties about 2-Pyrimidineethanol are: (1)ACD/LogP: -0.677; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.68; (4)ACD/LogD (pH 7.4): -0.68; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 10.20; (8)ACD/KOC (pH 7.4): 10.20; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 46.01 Å²; (13)Index of Refraction: 1.544; (14)Molar Refractivity: 33.52 cm³; (15)Molar Volume: 106.204 cm³; (16)Polarizability: 13.288×10^-24cm³; (17)Surface Tension: 54.752 dyne/cm; (18)Density: 1.169 g/cm³; (19)Flash Point: 89.866 °C; (20)Enthalpy of Vaporization: 48.777 kJ/mol; (21)Boiling Point: 224.981 °C at 760 mmHg; (22)Vapour Pressure: 0.050 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCCc1ncccn1;
(2) InChI: InChI=1S/C6H8N2O/c9-5-2-6-7-3-1-4-8-6/h1,3-4,9H,2,5H2;
(3) InChIKey: YYIWCGLAEFPUFI-UHFFFAOYSA-N.