1,3-Benzodioxol-2-amine, hexahydro-N,N-dimethyl-
Basic information
- CAS
59556-72-8- Standard SMILES
CN(C)C1OC2CCCCC2O1- InChIKey
HLGBDKBWQDEKFN-UHFFFAOYSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- 1,3-Benzodioxol-2-amine, hexahydro-N,N-dimethyl-
- IUPAC
- N,N-dimethyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-2-amine
Names & synonyms
1,3-Benzodioxol-2-amine, hexahydro-N,N-dimethyl-59556-72-8DTXSID80336697RefChem:217826DTXCID70287785HLGBDKBWQDEKFN-UHFFFAOYSA-NN,N-Dimethylhexahydro-1,3-benzodioxol-2-amine #N,N-Dimethylhexahydro-2H-1,3-benzodioxol-2-amine
Database identifiers
- CAS
59556-72-8- PubChem CID
- 535607
- DTXSID
DTXSID80336697
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 147
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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