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122438-02-2 | Ethanone, 1-[6-chloro-2-(4-morpholinyl)-2H-1-benzopyran-3-yl]-
CAS No: 122438-02-2 Catalog No: AG00177S MDL No:
Product Description
Catalog Number:
AG00177S
Chemical Name:
Ethanone, 1-[6-chloro-2-(4-morpholinyl)-2H-1-benzopyran-3-yl]-
CAS Number:
122438-02-2
Molecular Formula:
C15H16ClNO3
Molecular Weight:
293.7454
IUPAC Name:
1-(6-chloro-2-morpholin-4-yl-2H-chromen-3-yl)ethanone
InChI:
InChI=1S/C15H16ClNO3/c1-10(18)13-9-11-8-12(16)2-3-14(11)20-15(13)17-4-6-19-7-5-17/h2-3,8-9,15H,4-7H2,1H3
InChI Key:
GBRJDRVCPKCMBI-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C=C(C(O2)N1CCOCC1)C(=O)C
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.082g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.747g/mol
Monoisotopic Mass:
293.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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