Basic information
- CAS
36094-50-5- Standard SMILES
CC12CC3(C)CC(C)(C1)CC(C(Cl)C(=O)NC(C)(C)C)(C2)C3- InChIKey
JPBWYQLAOAFLNW-UHFFFAOYSA-N- Molecular formula
- C19H32ClNO
- Average molar mass
- 325.9 g/mol
- Monoisotopic mass
- 325.2172423
Names & identifiers
- Preferred name
- N-tert-Butyl-2-chloro-2-(3,5,7-trimethyltricyclo[3.3.1.1~3,7~]decan-1-yl)acetamide
- IUPAC
- N-tert-butyl-2-chloro-2-(3,5,7-trimethyl-1-adamantyl)acetamide
Names & synonyms
36094-50-5NSC251760DTXSID40330378NSC-251760N-tert-Butyl-2-chloro-2-(3,5,7-trimethyltricyclo[3.3.1.1~3,7~]decan-1-yl)acetamideDS-0040262-chloro-N-tert-butyl-2-(3,5,7-trimethyl-1-adamantyl)acetamideN-tert-Butyl-2-chloro-2-(3,5,7-trimethyladamantan-1-yl)acetamide.ALPHA.-CHLORO-N-(1,5,7-TRIMETHYLTRICYLCO[3.3.1.1(3,7)]DECANE-1-ACETAMIDE
Database identifiers
- CAS
36094-50-5- PubChem CID
- 429255
- DTXSID
DTXSID40330378
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 447
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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