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| Name |
6-Hydroxy-2-thio-8-azapurine |
EINECS | N/A |
| CAS No. | 31571-52-5 | Density | 2.43g/cm3 |
| PSA | 122.31000 | LogP | -0.29620 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C4H3 N5 O S | Boiling Point | °Cat760mmHg |
| Molecular Weight | 169.167 | Flash Point | °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and SOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1H-v-Triazolo[4,5-d]pyrimidin-7-ol,5-mercapto- (6CI); 1H-v-Triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione, 5-thio-(8CI); 7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 1,4,5,6-tetrahydro-5-thioxo-(9CI); 2-Thio-8-azaxanthine; 8-Azathioxanthine; NSC 75811 |
6-Hydroxy-2-thio-8-azapurine Chemical Properties
Product Name: 6-Hydroxy-2-thio-8-azapurine (CAS NO.31571-52-5)
Molecular Formula: C4H3N5OS
Molecular Weight: 169.18g/mol
Mol File: 31571-52-5.mol
Density: 2.43g/cm3
Surface Tension: 126.2 dyne/cm
XLogP3-AA: 0
H-Bond Donor: 3
H-Bond Acceptor: 4
IUPAC Name: 5-sulfanylidene-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one
Canonical SMILES: C12=NNNC1=NC(=S)NC2=O
InChI: InChI=1S/C4H3N5OS/c10-3-1-2(8-9-7-1)5-4(11)6-3/h(H3,5,6,7,8,9,10,11)
InChIKey: YLORBLDFYRRZLA-UHFFFAOYSA-N
6-Hydroxy-2-thio-8-azapurine Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 200mg/kg (200mg/kg) | National Technical Information Service. Vol. AD277-689, |
6-Hydroxy-2-thio-8-azapurine Consensus Reports
Reported in EPA TSCA Inventory.
6-Hydroxy-2-thio-8-azapurine Safety Profile
A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and SOx.
6-Hydroxy-2-thio-8-azapurine Specification
6-Hydroxy-2-thio-8-azapurine ,its CAS NO. is 31571-52-5,the synonyms is 2-Thio-6-hydroxy-8-azapurine ; 3H-s-Triazolo(4,5-d)pyrimidin-7(4H,6H)-one, 5-thiono- ; 5-Thiono-s-triazolo(4,5-d)pyrimidin-7(4H,6H)-one ; 8-Aza-2-thioxanthine ; 8-Azapurine, 6-hydroxy-2-thio- ; 8-Azathioxanthine ; EINECS 250-710-1 ; NSC 75811 ; USAF CB-25 ; 1,4,5,6-Tetrahydro-5-thioxo-7H-1,2,3-triazolo(4,5-d)pyrimidin-7-one ; 1H-v-Triazolo(4,5-d)pyrimidine-5,7(4H,6H)-dione,5-thio- (8CI) ; 3H-v-Triazolo(4,5-d)pyrimidin-7(4H,6H)-one, 5-thiono- ; 7H-1,2,3-Triazolo(4,5-d)pyrimidin-7-one, 1,4,5,6-tetrahydro-5-thioxo- ; 7H-1,2,3-Triazolo(4,5-d)pyrimidin-7-one, 3,4,5,6-tetrahydro-5-thioxo- .
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