Basic information
- CAS
18300-68-0- Standard SMILES
CC(=NNC(N)=O)c1ccc(N)cc1- InChIKey
SDKXJACVTWIKTG-UHFFFAOYSA-N- Molecular formula
- C9H12N4O
- Average molar mass
- 192.22 g/mol
- Monoisotopic mass
- 192.10111102
Names & identifiers
- Preferred name
- [1-(4-Aminophenyl)ethylideneamino]urea
- IUPAC
- [1-(4-aminophenyl)ethylideneamino]urea
- English name
- 1-(4-Aminophenyl)ethanone semicarbazone
- Molecular formula
- C9H12N4O
- Molecular weight
- 192.22
Names & synonyms
[1-(4-aminophenyl)ethylideneamino]urea18300-68-0Hydrazinecarboxamide, 2-[1-(4-aminophenyl)ethylidene]-CBDivE_001240p-aminoacetophenone semicarbazoneDTXSID203505392-[1-(4-Aminophenyl)ethylidene]hydrazine-1-carboxamide4'-Aminoacetophenone semicarbazone1-(4-Aminophenyl)ethanone semicarbazone1-[1-(4-Aminophenyl)ethylidene]semicarbazide
Database identifiers
- CAS
18300-68-0- PubChem CID
- 682124
- DTXSID
DTXSID20350539
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Melting point
- 276 °C · 276 °C
- Density
- 1.296 · 1.296±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.604 · 11.604±0.46(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…