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113769-76-9 | Ethanethione, 1-(4-morpholinyl)-2-[2-(phenylmethoxy)phenyl]-
CAS No: 113769-76-9 Catalog No: AG0009LQ MDL No:
Product Description
Catalog Number:
AG0009LQ
Chemical Name:
Ethanethione, 1-(4-morpholinyl)-2-[2-(phenylmethoxy)phenyl]-
CAS Number:
113769-76-9
Molecular Formula:
C19H21NO2S
Molecular Weight:
327.4405
IUPAC Name:
1-morpholin-4-yl-2-(2-phenylmethoxyphenyl)ethanethione
InChI:
InChI=1S/C19H21NO2S/c23-19(20-10-12-21-13-11-20)14-17-8-4-5-9-18(17)22-15-16-6-2-1-3-7-16/h1-9H,10-15H2
InChI Key:
GYHGYBOIRVDBFI-UHFFFAOYSA-N
SMILES:
S=C(N1CCOCC1)Cc1ccccc1OCc1ccccc1
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.129g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.442g/mol
Monoisotopic Mass:
327.129g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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