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927800-85-9 | 4-HYDROXY-6-METHOXY-2-N-PROPYLQUINOLINE
CAS No: 927800-85-9 Catalog No: AG00H0D5 MDL No:
Product Description
Catalog Number:
AG00H0D5
Chemical Name:
4-HYDROXY-6-METHOXY-2-N-PROPYLQUINOLINE
CAS Number:
927800-85-9
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
IUPAC Name:
6-methoxy-2-propyl-1H-quinolin-4-one
InChI:
InChI=1S/C13H15NO2/c1-3-4-9-7-13(15)11-8-10(16-2)5-6-12(11)14-9/h5-8H,3-4H2,1-2H3,(H,14,15)
InChI Key:
SILBPTYHCIOZFB-UHFFFAOYSA-N
SMILES:
CCCc1cc(O)c2c(n1)ccc(c2)OC
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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