Basic information
- CAS
52582-98-6- Standard SMILES
CNCCC12CC3CC(CC(C3)C1Cl)C2.Cl- InChIKey
BJVUKUWSDFUNPA-UHFFFAOYSA-N- Molecular formula
- C13H23Cl2N
- Average molar mass
- 264.23 g/mol
- Monoisotopic mass
- 263.1207551
Names & identifiers
- Preferred name
- 2-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)
- IUPAC
- 2-(2-chloro-1-adamantyl)-N-methylethanamine;hydrochloride
Names & synonyms
52582-98-6DTXSID609670092-(2-Chloroadamantan-1-yl)-N-methylethan-1-amine--hydrogen chloride (1/1)RefChem:1060844DTXCID9013946191-Adamantaneethylamine, 2-chloro-N-methyl-, hydrochloride2-Chloro-N-methyl-1-adamantaneethanamine hydrochlorideEthylamine, 2-(2-chloro-1-adamantyl)-N-methyl-, hydrochlorideADAMANTANE, 2-CHLORO-1-(2-(METHYLAMINO)ETHYL)-, HYDROCHLORIDECHEMBL3275765Tricyclo(3.3.1.1(3,7))decane-1-ethanamine, 2-chloro-N-methyl-, hydrochloride
Database identifiers
- CAS
52582-98-6- PubChem CID
- 40436
- DTXSID
DTXSID60967009- ChEMBL
CHEMBL3275765
Properties
Computed structural properties
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 239
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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