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| Name |
3-Hydroxy-9-methylguanine |
EINECS | N/A |
| CAS No. | 30345-28-9 | Density | 1.93g/cm3 |
| PSA | 99.69000 | LogP | -1.12040 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C6H7 N5 O2 | Boiling Point | 580.3°Cat760mmHg |
| Molecular Weight | 181.18 | Flash Point | 304.7°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Guanine,3-hydroxy-9-methyl- (8CI);2-Amino-3,9-dihydro-3-hydroxy-9-methyl-6H-purin-6-one; 3-Hydroxy-9-methylguanine |
3-Hydroxy-9-methylguanine Chemical Properties
Product Name: 3-Hydroxy-9-methylguanine (CAS NO.30345-28-9)
Molecular Formula: C6H7N5O2
Molecular Weight: 181.18g/mol
Mol File: 30345-28-9.mol
Boiling point: 580.3 °C at 760 mmHg
Flash Point: 304.7 °C
Density: 1.93 g/cm3
Surface Tension: 98.8 dyne/cm
Enthalpy of Vaporization: 91.31 kJ/mol
Vapour Pressure: 2.63E-14 mmHg at 25°C
XLogP3-AA: -1.4
H-Bond Donor: 2
H-Bond Acceptor: 5
Structure Descriptors of 3-Hydroxy-9-methylguanine (CAS NO.30345-28-9):
IUPAC Name: 2-Amino-3-hydroxy-9-methylpurin-6-one
Canonical SMILES: CN1C=NC2=C1N(C(=NC2=O)N)O
InChI: InChI=1S/C6H7N5O2/c1-10-2-8-3-4(12)9-6(7)11(13)5(3)10/h2,13H,1H3,(H2,7,9,12)
InChIKey: YMTGEOSREYBIRL-UHFFFAOYSA-N
3-Hydroxy-9-methylguanine Safety Profile
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of NOx.
3-Hydroxy-9-methylguanine Specification
3-Hydroxy-9-methylguanine , its CAS NO. is 30345-28-9, the synonyms are BRN 1117858 ; EINECS 250-138-2 ; 2-Amino-3,9-dihydro-3-hydroxy-9-methyl-6H-purin-6-one ; Guanine, 3-hydroxy-9-methyl- .
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