Basic information
- CAS
87072-65-9- Standard SMILES
CC(=O)N(C)N=Nc1ccc(F)cc1- InChIKey
WSWWDYQTCUZLON-UHFFFAOYSA-N- Molecular formula
- C9H10FN3O
- Average molar mass
- 195.19 g/mol
- Monoisotopic mass
- 195.08079011
Names & identifiers
- Preferred name
- C9H10FN3O
- IUPAC
- N-[(4-fluorophenyl)diazenyl]-N-methylacetamide
Names & synonyms
87072-65-9C9H10FN3ONSC291872DTXSID40315084NSC-291872Acetic acid, 2-[(4-fluorophenyl)imino]-1-methylhydrazide1-[3-(4-Fluorophenyl)-1-methyltriaz-2-en-1-yl]ethan-1-one
Database identifiers
- CAS
87072-65-9- PubChem CID
- 324896
- DTXSID
DTXSID40315084- Nikkaji
- J1.590.293K
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 224
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP2.77
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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