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934192-22-0 | 1-Cbz-2,3-dihydroquinolin-4(1H)-one
CAS No: 934192-22-0 Catalog No: AG01DET5 MDL No:MFCD30833847
Product Description
Catalog Number:
AG01DET5
Chemical Name:
1-Cbz-2,3-dihydroquinolin-4(1H)-one
CAS Number:
934192-22-0
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
MDL Number:
MFCD30833847
IUPAC Name:
benzyl 4-oxo-2,3-dihydroquinoline-1-carboxylate
InChI:
InChI=1S/C17H15NO3/c19-16-10-11-18(15-9-5-4-8-14(15)16)17(20)21-12-13-6-2-1-3-7-13/h1-9H,10-12H2
InChI Key:
ARPDGNMOSXCMJJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(=O)c2c1cccc2)OCc1ccccc1
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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