6-(benzenesulfonyl)-N,N-dimethylhex-2-yn-1-amine
Basic information
- CAS
82276-03-7- Standard SMILES
CN(C)CC#CCCCS(=O)(=O)c1ccccc1- InChIKey
YPNZXZUEKATWOV-UHFFFAOYSA-N- Molecular formula
- C14H19NO2S
- Average molar mass
- 265.37 g/mol
- Monoisotopic mass
- 265.11365002
Names & identifiers
- Preferred name
- 6-(benzenesulfonyl)-N,N-dimethylhex-2-yn-1-amine
- IUPAC
- 6-(benzenesulfonyl)-N,N-dimethylhex-2-yn-1-amine
Names & synonyms
82276-03-76-(benzenesulfonyl)-N,N-dimethylhex-2-yn-1-amineNSC363830DTXSID00320715NSC-363830DS-0133212-Hexyn-1-amine,n,n-dimethyl-6-(phenylsulfonyl)-
Database identifiers
- CAS
82276-03-7- PubChem CID
- 338958
- DTXSID
DTXSID00320715
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 388
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Compound notes
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