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Basic information
- CAS
2946-89-6- Standard SMILES
Cc1cc(C)n(C(N)=N[N+](=O)[O-])n1- InChIKey
YJQYMUPERFRTJO-UHFFFAOYSA-N- Molecular formula
- C6H9N5O2
- Average molar mass
- 183.17 g/mol
Overview
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Names & identifiers
- Preferred name
- 1-[(2-hydroxy-2-oxidohydrazino)(imino)methyl]-3,5-dimethyl-1H-pyrazole
- IUPAC
- 3,5-dimethyl-N'-nitropyrazole-1-carboximidamide
Names & synonyms
1-NITROGUANYL-3,5-DIMETHYL-PYRAZOLE3,5-dimethyl-N'-nitropyrazole-1-carboximidamide1-[(2-hydroxy-2-oxidohydrazino)(imino)methyl]-3,5-dimethyl-1H-pyrazoleSCHEMBL2085732SY2887013,5-dimethyl-N'-nitro-1H-pyrazole-1-carboximidamide
Database identifiers
- CAS
2946-89-6- PubChem CID
- 76278
Properties
Computed structural propertiesFilling in
- XLogP
- 0.8
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 236
Chemistry & industry
Suppliers2 total
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Related reactions
2 records
Compound notes
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