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7469-86-5 | 1-(4-Methoxyphenyl)-2-quinolin-2-ylethanone
CAS No: 7469-86-5 Catalog No: AG005A5S MDL No:MFCD04037914
Product Description
Catalog Number:
AG005A5S
Chemical Name:
1-(4-Methoxyphenyl)-2-quinolin-2-ylethanone
CAS Number:
7469-86-5
Molecular Formula:
C18H15NO2
Molecular Weight:
277.3172
MDL Number:
MFCD04037914
IUPAC Name:
1-(4-methoxyphenyl)-2-quinolin-2-ylethanone
InChI:
InChI=1S/C18H15NO2/c1-21-16-10-7-14(8-11-16)18(20)12-15-9-6-13-4-2-3-5-17(13)19-15/h2-11H,12H2,1H3
InChI Key:
XEXQEYGNRKJASK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(=O)Cc1ccc2c(n1)cccc2
NSC Number:
402302
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.11g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.323g/mol
Monoisotopic Mass:
277.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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