Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4-Pyrimidinemethanol |
EINECS | N/A |
CAS No. | 33581-98-5 | Density | 1.228 g/cm3 |
PSA | 46.01000 | LogP | -0.03110 |
Solubility | N/A | 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 | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-(Hydroxymethyl)pyrimidine;4-Pyrimidinemethanol (9CI);Pyrimidin-4-yl-methanol; |
Article Data | 6 |
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