4-(4-Chlorophenyl)-1,1-dimethylsemicarbazide
Basic information
- CAS
19102-30-8- Standard SMILES
CN(C)NC(=O)Nc1ccc(Cl)cc1- InChIKey
HULGFKUVDKFEMI-UHFFFAOYSA-N- Molecular formula
- C9H12ClN3O
- Average molar mass
- 213.66 g/mol
- Monoisotopic mass
- 213.0668897
Names & identifiers
- Preferred name
- 4-(4-Chlorophenyl)-1,1-dimethylsemicarbazide
- IUPAC
- 1-(4-chlorophenyl)-3-(dimethylamino)urea
Names & synonyms
19102-30-8RefChem:5140644-(4-Chlorophenyl)-1,1-dimethylsemicarbazide665-642-1N-(4-Chlorophenyl)-2,2-dimethylhydrazinecarboxamideAKOS024334512
Database identifiers
- CAS
19102-30-8- PubChem CID
- 3307285
- EC Number
- 665-642-1
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 44.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 190
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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