8-methoxy-9-methyl-...

8-methoxy-9-methyl-2-propan-2-yl-2,3-dihydrofuro[2,3-b]quinolin-4-one 52486-77-8

8-methoxy-9-methyl-2-propan-2-yl-2,3-dihydrofuro[2,3-b]quinolin-4-one 52486-77-8

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Keywords

2-Isopropyl-8-methoxy-9-methyl-3,9-dihydrofuro[2,3-b]quinolin-4(2H)-one 8-methoxy-9-methyl-2-propan-2-yl-2,3-dihydrofuro[2,3-b]quinolin-4-one 52486-77-8

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  • Appearance:Liquid
  • Application:Organic Chemicals
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  • ProductionCapacity:10|Kilogram|Month
  • Storage:room temperature
  • Transportation:as requested

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Details:

Identification and Related Records
【Name】
8-methoxy-9-methyl-2-(propan-2-yl)-3,9-dihydrofuro[2,3-b]quinolin-4(2H)-one
【Iupac name】
8-methoxy-9-methyl-2-propan-2-yl-2,3-dihydrofuro[2,3-b]quinolin-4-one
【CAS Registry number】
52486-77-8
【Synonyms】
2-Isopropyl-8-methoxy-9-methyl-3,9-dihydrofuro[2,3-b]quinolin-4(2H)-one
【Molecular Formula】
C16H19NO3 (Products with the same molecular formula)
【Molecular Weight】
273.327
【Inchi】
InChI=1/C16H19NO3/c1-9(2)13-8-11-15(18)10-6-5-7-12(19-4)14(10)17(3)16(11)20-13/h5-7,9,13H,8H2,1-4H3
【Canonical SMILES】
CC(C)C1CC2=C(O1)N(C3=C(C2=O)C=CC=C3OC)C
【MOL File】
52486-77-8.mol
Chemical and Physical Properties
【Density】
1.21g/cm3
【Boiling Point】
397.4°C at 760 mmHg
【Refractive Index】
1.586
【Flash Point】
194.1°C
【Computed Properties】
Molecular Weight:273.32696 [g/mol]
Molecular Formula:C16H19NO3
XLogP3-AA:3.3
H-Bond Donor:0
H-Bond Acceptor:4
Rotatable Bond Count:2
Exact Mass:273.136493
MonoIsotopic Mass:273.136493
Topological Polar Surface Area:38.8
Heavy Atom Count:20
Formal Charge:0
Complexity:443
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Cation Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:3
Effective Rotor Count:2.6
Conformer Sampling RMSD:0.6
CID Conformer Count:5

 

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