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Home > Quinoline > 105677-49-4
105677-49-4 | 4-Quinolinol, 2-methoxy-3-(3-methyl-2-butenyl)-
CAS No: 105677-49-4 Catalog No: AG007DLO MDL No:
Product Description
Catalog Number:
AG007DLO
Chemical Name:
4-Quinolinol, 2-methoxy-3-(3-methyl-2-butenyl)-
CAS Number:
105677-49-4
Molecular Formula:
C15H17NO2
Molecular Weight:
243.3010
IUPAC Name:
2-methoxy-3-(3-methylbut-2-enyl)-1H-quinolin-4-one
InChI:
InChI=1S/C15H17NO2/c1-10(2)8-9-12-14(17)11-6-4-5-7-13(11)16-15(12)18-3/h4-8H,9H2,1-3H3,(H,16,17)
InChI Key:
SDFPLXCPFHPDRP-UHFFFAOYSA-N
SMILES:
COc1nc2ccccc2c(c1CC=C(C)C)O
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.306g/mol
Monoisotopic Mass:
243.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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