Basic information
- CAS
41208-07-5- Standard SMILES
CC1=CC(C)(C)Nc2ccc(Cc3ccc4c(c3)C(C)=CC(C)(C)N4)cc21- InChIKey
ADHZMOYUJKFKSE-UHFFFAOYSA-N- Molecular formula
- C25H30N2
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.24089896
Overview
structure
Names & identifiers
- Preferred name
- 6,6'-Methylenebis(1,2-dihydro-2,2,4-trimethylquinoline)
- IUPAC
- 2,2,4-trimethyl-6-[(2,2,4-trimethyl-1H-quinolin-6-yl)methyl]-1H-quinoline
- English name
- Sensorad
- Molecular formula
- C25H30N2
- Molecular weight
- 358.52
Names & synonyms
SensoradMTDQ41208-07-56,6'-Methylenebis(1,2-dihydro-2,2,4-trimethylquinoline)6BX61HE35O6,6'-Methylene bis(2,2,4-trimethyl-1,2-dihydroquinoline)NSC-217697Quinoline, 6,6'-methylenebis(1,2-dihydro-2,2,4-trimethyl-DTXSID30194128RefChem:103748DTXCID40116619MLS000756546
Show more names
Bis(1,2-dihydro-2,2,4-trimethylquinolin-6-yl)methaneQuinoline, 6,6'-methylenebis[1,2-dihydro-2,2,4-trimethyl-
Quinoline, 6,6'-methylenebis(1,2-dihydro-2,2,4-trimethyl)-6,6'-METHYLENEBIS(2,2,4-TRIMETHYL-1,2-DIHYDROQUINOLINE)NSC 217697BRN 0323757Quinoline, 6,6'-methylenebis[1,2-dihydro-2,2,4-trimethyl]-UNII-6BX61HE35O4-23-00-01927 (Beilstein Handbook Reference)SCHEMBL9450756
Database identifiers
- CAS
41208-07-5- PubChem CID
- 99342
- DTXSID
DTXSID30194128- ChEMBL
CHEMBL1440240- UNII
- 6BX61HE35O
- Nikkaji
- J54.281D
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 572
Physicochemical properties
- Melting point
- 84.5 °C · 84.5°C
- Boiling point
- 480.93 °C · 480.93°C (rough estimate)
- Density
- 1.1393 · 1.1393 (rough estimate)
- refractive index
- 1.762 · 1.7620 (estimate)
- pka
- 4 · 4+-.0.70(Predicted)
- FDA UNII
- 6 BX61HE35O · 6BX61HE35O
Chemistry & industry
Suppliers2 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
CHEMICAL LAND21[email protected]
Related reactions
1 records
Compound notes
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