1-Ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline
Basic information
- CAS
105532-25-0- Standard SMILES
CCN1CCCc2cc(OC)ccc21- InChIKey
MRNKTNYEAZTWBE-UHFFFAOYSA-N- Molecular formula
- C12H17NO
- Average molar mass
- 191.27 g/mol
Names & identifiers
- Preferred name
- 1-Ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline
- IUPAC
- 1-ethyl-6-methoxy-3,4-dihydro-2H-quinoline
- English name
- 1-Ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline
- Molecular formula
- C12H17NO
- Molecular weight
- 191.27
Names & synonyms
1-Ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline105532-25-01-ethyl-6-methoxy-3,4-dihydro-2H-quinolineMFCD31715308SCHEMBL12061308AKOS037648498SB67471BS-14243CS-0162594E74360Quinoline, 1-ethyl-1,2,3,4-tetrahydro-6-methoxy-
Database identifiers
- CAS
105532-25-0
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 329.2 · 329.2±35.0 °C(Predicted)
- Density
- 1.012 · 1.012±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 7.53 · 7.53±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…