4-Pyrimidinemethanol supplier

Name
PYRIMIDIN-4-YL-METHANOL
EINECS
CAS No. 33581-98-5
Article Data6
CAS DataBase
Density 1.228 g/cm³
Solubility
Melting Point 75-78℃
Formula C₅H₆N₂O
Boiling Point 250.784 °C at 760 mmHg
Molecular Weight 110.115
Flash Point 105.47 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4-(Hydroxymethyl)pyrimidine;4-Pyrimidinemethanol (9CI);Pyrimidin-4-yl-methanol;
PSA 46.01000
LogP -0.03110

4-Pyrimidinemethanol Specification

The CAS register number of 4-Pyrimidinemethanol is 33581-98-5. It also can be called as 4-(Hydroxymethyl)pyrimidine and the systematic name about this chemical is pyrimidin-4-ylmethanol. The molecular formula about this chemical is C₅H₆N₂O and the molecular weight is 110.11. It belongs to the following product categorie which includes Pyrimidine.

Physical properties about 4-Pyrimidinemethanol are: (1)ACD/LogP: -0.73; (2)ACD/LogD (pH 5.5): -2; (3)ACD/LogD (pH 7.4): -2; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 4; (7)ACD/KOC (pH 7.4): 4; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 46.01 Å²; (12)Index of Refraction: 1.557; (13)Molar Refractivity: 28.887 cm³; (14)Molar Volume: 89.697 cm³; (15)Polarizability: 11.452x10^-24cm³; (16)Surface Tension: 59.491 dyne/cm; (17)Density: 1.228 g/cm³; (18)Flash Point: 105.47 °C; (19)Enthalpy of Vaporization: 51.571 kJ/mol; (20)Boiling Point: 250.784 °C at 760 mmHg; (21)Vapour Pressure: 0.011 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: OCc1ccncn1
(2)InChI: InChI=1/C5H6N2O/c8-3-5-1-2-6-4-7-5/h1-2,4,8H,3H2
(3)InChIKey: OEYVFRVNVPKHQQ-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C5H6N2O/c8-3-5-1-2-6-4-7-5/h1-2,4,8H,3H2
(5)Std. InChIKey: OEYVFRVNVPKHQQ-UHFFFAOYSA-N

Product Name

PYRIMIDIN-4-YL-METHANOL

4-Pyrimidinemethanol Specification

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