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| CAS No.: | 23590-99-0 |
|---|---|
| Name: | INOSINE, PERIODATE OXIDIZED |
| Molecular Structure: | |
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| Formula: | C10H10 N4 O5 |
| Molecular Weight: | 266.213 |
| Synonyms: | 9H-Purine-9-acetaldehyde,a-(1-formyl-2-hydroxyethoxy)-1,6-dihydro-6-oxo-,(R,R)- (8CI); 9H-Purine-9-acetaldehyde, a-(1-formyl-2-hydroxyethoxy)-1,6-dihydro-6-oxo-,[R-(R*,R*)]-; Diglycoaldehyde; Inosine dialdehyde; Inox; NSC 118994; Ribox |
| Density: | 1.69 g/cm3 |
| Melting Point: | 148-150 °C(Solv: ethanol (64-17-5)) |
| Boiling Point: | 574.4 °C at 760 mmHg |
| Flash Point: | 301.2 °C |
| Hazard Symbols: | Moderately toxic. |
| Safety: | Moderately toxic by intravenous route.Mutation data reported. When heated to decomposition it emits toxic vapors of NOx. |
| PSA: | 127.17000 |
| LogP: | -1.60650 |
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Chemistry
Molecular Structure of Inosine dialdehyde (CAS NO. 23590-99-0):
IUPAC Name: (2S)-3-Hydroxy-2-[(1S)-2-oxo-1-(6-oxo-3H-purin-9-yl)ethoxy]propanal
Molecular Formula: C10H10N4O5
Molecular Weight: 266.210200 g/mol
XLogP3-AA: -2
H-Bond Donor: 2
H-Bond Acceptor: 7
Canonical SMILES: C1=NC(=O)C2=C(N1)N(C=N2)C(C=O)OC(CO)C=O
Isomeric SMILES: C1=NC(=O)C2=C(N1)N(C=N2)[C@H](C=O)O[C@@H](CO)C=O
InChI: 1S/C10H10N4O5/c15-1-6(2-16)19-7(3-17)14-5-13-8-9(14)11-4-12-10(8)18/h1,3-7,16H,2H2,(H,11,12,18)/t6-,7+/m1/s1
InChIKey: RGWOFTGZWJGPHG-RQJHMYQMSA-N
Index of Refraction: 1.71
Molar Refractivity: 61.44 cm3
Molar Volume: 157.1 cm3
Surface Tension: 77.3 dyne/cm
Density: 1.69 g/cm3
Flash Point: 301.2 °C
Enthalpy of Vaporization: 90.54 kJ/mol
Boiling Point: 574.4 °C at 760 mmHg
Vapour Pressure: 4.9E-14 mmHg at 25 °C
Water Solubility of Inosine dialdehyde (CAS NO. 23590-99-0): 1e+006 mg/L at 25 °C
Toxicity Data With Reference
| 1. | dni-rat-oth 830 µmol/L | CNREA8 Cancer Research. 37 (1977),2188. | ||
| 2. | uns-rat-oth 830 µmol/L | CNREA8 Cancer Research. 37 (1977),2188. | ||
| 3. | dni-mus-lym 1 mmol/L | BCPCA6 Biochemical Pharmacology. 34 (1985),1717. | ||
| 4. | uns-mus-lym 1 mmol/L | BCPCA6 Biochemical Pharmacology. 34 (1985),1717. | ||
| 5. | ivn-mus LD50:567 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) PB82-166125 . |
Safety Profile
Moderately toxic by intravenous route.Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
Specification
Inosine dialdehyde with cas registry number of 23590-99-0 is also known as (R,R)-alpha-(1-Formyl-2-hydroxyethoxy)-1,6-dihydro-6-oxo-9H-purine-9-acetaldehyde ; 9H-Purine-9-acetaldehyde, alpha-(1-formyl-2-hydroxyethoxy)-1,6-dihydro-6-oxo-, (R,(R*,R*))- ; 9H-Purine-9-acetaldehyde, alpha-(1-formyl-2-hydroxyethoxy)-1,6-dihydro-6-oxo-, (R,R)- ; alpha-(Hydroxymethyl)-alpha'-(6-hydroxy-9H-purin-9-yl) diglycolaldehyde ; Diglycoaldehyde ; INOX ; NSC 118994 .