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Basic information
- CAS
91296-17-2- Standard SMILES
CCOC(Cn1ncc(C#N)c1N)OCC- InChIKey
UDYIMDLENVIMQC-UHFFFAOYSA-N- Molecular formula
- C10H16N4O2
- Average molar mass
- 224.26 g/mol
- Monoisotopic mass
- 224.12732577
Names & identifiers
- Preferred name
- 5-Amino-4-cyano-1-(2,2-diethoxyethyl)pyrazole
- IUPAC
- 5-amino-1-(2,2-diethoxyethyl)pyrazole-4-carbonitrile
Names & synonyms
NSC37040091296-17-25-amino-4-cyano-1-(2,2-diethoxyethyl)pyrazoleSCHEMBL9300712DTXSID10321117UDYIMDLENVIMQC-UHFFFAOYSA-NNSC-3704005-amino-4-cyano-1-(2,2-diethoxyethyl)-pyrazole5-Amino-1-(2,2-diethoxyethyl)-1H-pyrazole-4-carbonitrile
Database identifiers
- CAS
91296-17-2- PubChem CID
- 340243
- DTXSID
DTXSID10321117
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Related reactions
4 records
Compound notes
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