Basic information
- CAS
94166-48-0- Standard SMILES
CC(C)(C)C(=O)NNc1ccc(N=C=O)cc1Cl- InChIKey
ZOTAFLXGCCHEDV-UHFFFAOYSA-N- Molecular formula
- C12H14ClN3O2
- Average molar mass
- 267.71 g/mol
- Monoisotopic mass
- 267.0774544
Names & identifiers
- Preferred name
- N'-(2-Chloro-4-isocyanatophenyl)-2,2-dimethylpropionohydrazide
- IUPAC
- N'-(2-chloro-4-isocyanatophenyl)-2,2-dimethylpropanehydrazide
- English name
- N'-(2-chloro-4-isocyanatophenyl)-2,2-dimethylpropionohydrazide
- Molecular formula
- C12H14ClN3O2
- Molecular weight
- 267.71146
Names & synonyms
94166-48-0N'-(2-Chloro-4-isocyanatophenyl)-2,2-dimethylpropionohydrazideEINECS 303-343-7N'-(2-Chloro-4-isocyanatophenyl)pivalohydrazideN'-(2-chloro-4-isocyanatophenyl)-2,2-dimethylpropanehydrazidePX7VY2BDU6DTXSID20240906ZOTAFLXGCCHEDV-UHFFFAOYSA-NNS000402032,2-Dimethylpropanoic acid 2-(2-chloro-4-isocyanatophenyl)hydrazideN'-(2-Chloro-4-isocyanatophenyl)-2,2-dimethylpropionic acid hydrazide
Database identifiers
- CAS
94166-48-0- PubChem CID
- 3023908
- DTXSID
DTXSID20240906- UNII
- PX7VY2BDU6
- EC Number
- 303-343-7
- Nikkaji
- J319.010B
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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