2-Amino-6-methyl-5-prop-2-enyl-1H-pyrimidin-4-one supplier

Name
5-ALLYL-2-AMINO-6-METHYL-PYRIMIDIN-4-OL
EINECS
CAS No. 6957-86-4
Article Data3
CAS DataBase
Density 1.22 g/cm³
Solubility
Melting Point
Formula C₈H₁₁N₃O
Boiling Point 286.4 °C at 760 mmHg
Molecular Weight 165.1924
Flash Point 127 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4(3H)-pyrimidinone, 2-amino-6-methyl-5-(2-propen-1-yl)-;2-Amino-6-methyl-5-(prop-2-en-1-yl)pyrimidin-4-ol;5-Allyl-2-amino-6-methylpyrimidin-4(3H)-one;
PSA 72.03000
LogP 1.38250

2-Amino-6-methyl-5-prop-2-enyl-1H-pyrimidin-4-one Specification

The CAS register number of 2-Amino-6-methyl-5-prop-2-enyl-1H-pyrimidin-4-one is 6957-86-4. It also can be called as 4(3H)-pyrimidinone, 2-amino-6-methyl-5-(2-propen-1-yl)- and the IUPAC name about this chemical is 2-amino-6-methyl-5-prop-2-enyl-1H-pyrimidin-4-one. The molecular formula about this chemical is C₈H₁₁N₃O and the molecular weight is 165.19.

Physical properties about 2-Amino-6-methyl-5-prop-2-enyl-1H-pyrimidin-4-one are: (1)ACD/LogP: 0.98; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 35.91Å²; (10)Index of Refraction: 1.589; (11)Molar Refractivity: 45.36 cm³; (12)Molar Volume: 134.5 cm³; (13)Polarizability: 17.98x10^-24cm³; (14)Surface Tension: 43.6 dyne/cm; (15)Enthalpy of Vaporization: 52.56 kJ/mol; (16)Boiling Point: 286.4 °C at 760 mmHg; (17)Vapour Pressure: 0.00264 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C/1/N=C(\N\C(=C\1C/C=C)C)N
(2)InChI: InChI=1/C8H11N3O/c1-3-4-6-5(2)10-8(9)11-7(6)12/h3H,1,4H2,2H3,(H3,9,10,11,12)
(3)InChIKey: GHNPMIYKCHMCDS-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C8H11N3O/c1-3-4-6-5(2)10-8(9)11-7(6)12/h3H,1,4H2,2H3,(H3,9,10,11,12)
(5)Std. InChIKey: GHNPMIYKCHMCDS-UHFFFAOYSA-N

Product Name

5-ALLYL-2-AMINO-6-METHYL-PYRIMIDIN-4-OL

2-Amino-6-methyl-5-prop-2-enyl-1H-pyrimidin-4-one Specification

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