1-Nitroso-5,6-dihydrothymine
5-methyl-1-nitroso-1,3-diazinane-2,4-dione
Also Known As: 1-Nitroso-5,6-dihydrothymine|NDHT|5-methyl-1-nitroso-1,3-diazinane-2,4-dione|Thymine, 5,6-dihydro-1-nitroso-|LS-7565|Dihydro-5-methyl-1-nitroso-2,4(1H,3H)-pyrimidinedione|2,4(1H,3H)-Pyrimidinedione, dihydro-5-methyl-1-nitroso-|5-methyl-1-nitrosodihydropyrimidine-2,4(1H,3H)-dione|5,6-Dihydro-5-methyl-1-nitroso-2,4(1H,3H)-pyrimidinedione
CAS: 62641-67-2
| Molecular Formula | CC1CN(C(=O)NC1=O)N=O |
|---|---|
| Molecular Weight | 157.04874 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.04874 |
| Monoisotopic Mass | 157.04874 |
| Heavy Atoms | 11 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 62641-67-2 |
|---|---|
| SMILES | CC1CN(C(=O)NC1=O)N=O |
| InChIKey | VHNPZOQVSSWOJZ-UHFFFAOYSA-N |
Product Overview
1-Nitroso-5,6-dihydrothymine (CAS 62641-67-2), with molecular formula CC1CN(C(=O)NC1=O)N=O and molecular weight 157.04874 g/mol. IUPAC: 5-methyl-1-nitroso-1,3-diazinane-2,4-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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