6-Methyl-7-nitroso(1,2,4)triazolo(4,3-b)pyridazin-8(5H)-one
Basic information
- CAS
32002-30-5- Standard SMILES
Cc1[nH]n2cnnc2c(=O)c1N=O- InChIKey
IQYADAQFXZFGSA-UHFFFAOYSA-N- Molecular formula
- C6H5N5O2
- Average molar mass
- 179.14 g/mol
- Monoisotopic mass
- 179.04432442
Names & identifiers
- Preferred name
- 6-Methyl-7-nitroso(1,2,4)triazolo(4,3-b)pyridazin-8(5H)-one
- IUPAC
- 6-methyl-7-nitroso-5H-[1,2,4]triazolo[4,3-b]pyridazin-8-one
Names & synonyms
32002-30-5DTXSID209538876-methyl-7-nitroso[1,2,4]triazolo[4,3-b]pyridazin-8(5h)-one6-Methyl-7-nitroso(1,2,4)triazolo(4,3-b)pyridazin-8(5H)-oneRefChem:1074075DTXCID1013819276-methyl-7-nitroso-[1,2,4]triazolo[4,3-b]pyridazin-8-olBRN 11111936-Methyl-s-triazolo(4,3-b)pyridazine-7,8-dione 7-oximes-Triazolo(4,3-b)pyridazine-7,8-dione, 6-methyl-, 7-oximeAKOS040854301F3162-0181
Show more names
2877635-73-7
Database identifiers
- CAS
32002-30-5- PubChem CID
- 208338
- DTXSID
DTXSID20953887- Nikkaji
- J92.734A
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 89.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 299
Experimental & physicochemical properties
LogP-1.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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