Tert-butyl 4-amino-7,8-dichloro-3,4-dihydroquinoline-1(2H)-carboxylate
Basic information
- CAS
1211596-69-8- Standard SMILES
CC(C)(C)OC(=O)N1CCC(N)c2ccc(Cl)c(Cl)c21- InChIKey
DDESUWWHKNTWNC-UHFFFAOYSA-N- Molecular formula
- C14H18Cl2N2O2
- Average molar mass
- 317.2 g/mol
- Monoisotopic mass
- 316.0745332
Names & identifiers
- Preferred name
- Tert-butyl 4-amino-7,8-dichloro-3,4-dihydroquinoline-1(2H)-carboxylate
- IUPAC
- tert-butyl 4-amino-7,8-dichloro-3,4-dihydro-2H-quinoline-1-carboxylate
Names & synonyms
DTXSID7011397761,1-Dimethylethyl 4-amino-7,8-dichloro-3,4-dihydro-1(2H)-quinolinecarboxylateTERT-BUTYL 4-AMINO-7,8-DICHLORO-3,4-DIHYDROQUINOLINE-1(2H)-CARBOXYLATE1211596-69-8
Database identifiers
- CAS
1211596-69-8- PubChem CID
- 57366387
- DTXSID
DTXSID701139776
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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