Basic information
- CAS
320424-00-8- Standard SMILES
O=C(c1cc2c(s1)-c1ccccc1CC2)N1CCOCC1- InChIKey
NVPREAOAIOZWBR-UHFFFAOYSA-N- Molecular formula
- C17H17NO2S
- Average molar mass
- 299.4 g/mol
Names & identifiers
- Preferred name
- 4,5-Dihydronaphtho[1,2-b]thiophen-2-yl(morpholino)methanone
- IUPAC
- 4,5-dihydrobenzo[g][1]benzothiol-2-yl(morpholin-4-yl)methanone
- English name
- 4,5-Dihydronaphtho[1,2-b]thiophen-2-yl(morpholino)methanone
- Molecular formula
- C17H17NO2S
- Molecular weight
- 299.39
Names & synonyms
320424-00-84-{4H,5H-naphtho[1,2-b]thiophene-2-carbonyl}morpholine4,5-dihydronaphtho[1,2-b]thiophen-2-yl(morpholino)methanoneMFCD01569126(4,5-Dihydronaphtho[1,2-b]thiophen-2-yl)(morpholino)methanone4,5-dihydrobenzo[g][1]benzothiol-2-yl(morpholin-4-yl)methanoneOprea1_052646AKOS001376134CCG-34955712N-510SCS-0289301Z28250074
Show more names
Methanone, (4,5-dihydronaphtho[1,2-b]thien-2-yl)-4-morpholinyl-
4,5-dihydrobenzo[g]benzothiophen-2-yl(morpholino)methanone
Database identifiers
- CAS
320424-00-8
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 396
Physicochemical properties
- Boiling point
- 522.5 · 522.5±50.0 °C(Predicted)
- Density
- 1.292 · 1.292±0.06 g/cm3(Predicted)
- pka
- -1.63 · -1.63±0.20(Predicted)
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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