Home Other Building Blocks 2-(2-phenylphenoxy)ethanethioamide

2-(2-phenylphenoxy)ethanethioamide

CAS No.:
927994-99-8
Catalog Number:
AG019UPY
Molecular Formula:
C14H13NOS
Molecular Weight:
243.3241
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Product Description
Catalog Number:
AG019UPY
Chemical Name:
2-(2-phenylphenoxy)ethanethioamide
CAS Number:
927994-99-8
Molecular Formula:
C14H13NOS
Molecular Weight:
243.3241
MDL Number:
MFCD08164213
IUPAC Name:
2-(2-phenylphenoxy)ethanethioamide
InChI:
InChI=1S/C14H13NOS/c15-14(17)10-16-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9H,10H2,(H2,15,17)
InChI Key:
KUPRHYXSMNBRSE-UHFFFAOYSA-N
SMILES:
NC(=S)COc1ccccc1c1ccccc1
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.072g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.324g/mol
Monoisotopic Mass:
243.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties