Basic information
- CAS
102943-52-2- Standard SMILES
CC1=C(C=NNC(N)=O)CCCC1- InChIKey
SNORNDIJWKDGOY-UHFFFAOYSA-N- Molecular formula
- C9H15N3O
- Average molar mass
- 181.23 g/mol
- Monoisotopic mass
- 181.12151211
Names & identifiers
- Preferred name
- [(2-Methylcyclohexen-1-yl)methylideneamino]urea
- IUPAC
- [(2-methylcyclohexen-1-yl)methylideneamino]urea
- English name
- Hydrazinecarboxamide, 2-[(2-methyl-1-cyclohexen-1-yl)methylene]-
- Molecular formula
- C9H15N3O
- Molecular weight
- 181.23
Names & synonyms
[(2-methylcyclohexen-1-yl)methylideneamino]urea102943-52-22-Methyl-1-cyclohexene-1-carbaldehyde semicarbazoneDTXSID50338325AKOS0243411022-[(2-Methylcyclohex-1-en-1-yl)methylidene]hydrazine-1-carboxamide2-METHYL-1-CYCLOHEXENE-1-CARBOXALDEHYDE SEMICARBAZONEHydrazinecarboxamide, 2-[(2-methyl-1-cyclohexen-1-yl)methylene]-
Database identifiers
- CAS
102943-52-2- PubChem CID
- 548401
- DTXSID
DTXSID50338325
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 256
Physicochemical properties
- Melting point
- 232 · 232-233 °C
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 11.92 · 11.92±0.46(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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