4,5-Dihydro-3-(4-methoxyphenyl)-1-nitroso-1H-pyrazole
Basic information
- CAS
103274-17-5- Standard SMILES
COc1ccc(C2=NN(N=O)CC2)cc1- InChIKey
WQDHNGQXZMXTBE-UHFFFAOYSA-N- Molecular formula
- C10H11N3O2
- Average molar mass
- 205.21 g/mol
- Monoisotopic mass
- 205.0851266
Names & identifiers
- Preferred name
- 4,5-Dihydro-3-(4-methoxyphenyl)-1-nitroso-1H-pyrazole
- IUPAC
- 5-(4-methoxyphenyl)-2-nitroso-3,4-dihydropyrazole
Names & synonyms
4,5-Dihydro-3-(4-methoxyphenyl)-1-nitroso-1H-pyrazoleDTXSID401214117103274-17-53-(4-Methoxyphenyl)-1-nitroso-4,5-dihydro-1H-pyrazole
Database identifiers
- CAS
103274-17-5- PubChem CID
- 3526271
- DTXSID
DTXSID401214117
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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