8-Hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carboxaldehyde
Basic information
- CAS
115662-09-4- Standard SMILES
CC1(C)CCN2CCC(C)(C)c3c(O)c(C=O)cc1c32- InChIKey
ZBVWJSQPIHQKQJ-UHFFFAOYSA-N- Molecular formula
- C17H23NO2
- Average molar mass
- 273.37 g/mol
- Monoisotopic mass
- 273.17287898
Names & identifiers
- Preferred name
- 8-Hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carboxaldehyde
- IUPAC
- 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carbaldehyde
- English name
- 9-Formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine
- Molecular formula
- C17H23NO2
- Molecular weight
- 273.37
Names & synonyms
8-HYDROXY-1,1,7,7-TETRAMETHYL-2,3,6,7-TETRAHYDRO-1H,5H-PYRIDO[3,2,1-IJ]QUINOLINE-9-CARBOXALDEHYDE8-Hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1H,5H-pyrido(3,2,1-ij)quinoline-9-carboxaldehydeRefChem:548124890-048-6115662-09-48-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde9-Formyl-8-hydroxy-1,1,7,7-tetramethyljulolidineMFCD001427858-hydroxy-1,1,7,7-tetramethyl-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-carbaldehyde8-HYDROXY-1,1,7,7-TETRAMETHYL-2,3,6,7-TETRAHYDRO-1H,5H-PYRIDO[3,2,1-IJ]QUINOLINE-9-CARBALDEHYDE6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carbaldehyde1H,5H-benzo[ij]quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-
Show more names
8-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde>8-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde,99%8-HYDROXY-1,1,7,7-TETRAMETHYLJULOLIDINE-9-CARBOXALDEHYDE 99%2,3,6,7-Tetrahydro-8-hydroxy-1,1,7,7-tetramethyl-1H,5H-benzo[ij]quinolizine-9-carboxaldehyde
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 404
Physicochemical properties
- Melting point
- 74 · 74-77 °C
- Boiling point
- 416.39 °C · 416.39°C (rough estimate)
- Density
- 1.0101 · 1.0101 (rough estimate)
- refractive index
- 1.52 · 1.5200 (estimate)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- solubility
- soluble in Methanol
- form
- powder to crystal
- pka
- 9.5 · 9.50±0.60(Predicted)
- color
- White to Light yellow to Green
- Symbol(GHS)
- 7 · GHS07,GHS08
- Signal word
- Danger
- Hazard statements
- 315 · H315-H317-H319-H334
- Precautionary statements
- 261 · P261-P264-P272-P280-P284-P302+P352+P333+P313+P363-P304+P340+P342+P311-P305+P351+P338+P337+P313-P501
- Safety Statements
- 24 · 24/25
- HS Code
- 29339900 · 29339900
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Safety data
- hs_code
- 29339900
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS08
- safety_code
- 24/25
- Hazard statements
- H315-H317-H319-H334
- Precautionary statements
- P261-P264-P272-P280-P284-P302+P352+P333+P313+P363-P304+P340+P342+P311-P305+P351+P338+P337+P313-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
1 records
Compound notes
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