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| Name |
2-[(6-Amino-9H-purin-9-yl)methyl]-5-methyl-3-(2-methylphenyl)-4(3H)-quinazolinone |
EINECS | N/A |
| CAS No. | 371242-69-2 | Density | 1.436 g/cm3 |
| PSA | 104.51000 | LogP | 3.35390 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C22H19N7O | Boiling Point | 673.681 °C at 760 mmHg |
| Molecular Weight | 397.43 | Flash Point | 361.229 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
![Molecular Structure of 371242-69-2 (2-[(6-Amino-9H-purin-9-yl)methyl]-5-methyl-3-(2-methylphenyl)-4(3H)-quinazolinone)](http://www.lookchem.com/300w/201001/img/371242-69-2.jpg_ms)
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Hazard Symbols | N/A |
| Synonyms |
IC-87114 |
2-[(6-Amino-9H-purin-9-yl)methyl]-5-methyl-3-(2-methylphenyl)-4(3H)-quinazolinone Chemical Properties
Molecular Structure of 2-[(6-Amino-9H-purin-9-yl)methyl]-5-methyl-3-(2-methylphenyl)-4(3H)-quinazolinone (CAS No.371242-69-2):
Molecular Formula: C22H19N7O
Molecular Weight: 397.43
CAS No: 371242-69-2
H bond acceptors: 8
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 102.29 Å2
Index of Refraction: 1.759
Molar Refractivity: 113.716 cm3
Molar Volume: 276.686 cm3
Surface Tension: 61.519 dyne/cm
Density: 1.436 g/cm3
Flash Point: 361.229 °C
Enthalpy of Vaporization: 98.944 kJ/mol
Boiling Point: 673.681 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
InChI: InChI=1/C22H19N7O/c1-13-6-3-4-9-16(13)29-17(27-15-8-5-7-14(2)18(15)22(29)30)10-28-12-26-19-20(23)24-11-25-21(19)28/h3-9,11-12H,10H2,1-2H3,(H2,23,24,25)
InChIKey: GNWHRHGTIBRNSM-UHFFFAOYAL
Std. InChI: InChI=1S/C22H19N7O/c1-13-6-3-4-9-16(13)29-17(27-15-8-5-7-14(2)18(15)22(29)30)10-28-12-26-19-20(23)24-11-25-21(19)28/h3-9,11-12H,10H2,1-2H3,(H2,23,24,25)
Std. InChIKey: GNWHRHGTIBRNSM-UHFFFAOYSA-N
Systematic Name: 2-[(6-Amino-9H-purin-9-yl)methyl]-5-methyl-3-(2-methylphenyl)quinazolin-4(3H)-one
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