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155196-03-5 | Propanamide, N-[2-[(4-hydroxyphenyl)thio]ethyl]-
CAS No: 155196-03-5 Catalog No: AG001NPF MDL No:MFCD03844642
Product Description
Catalog Number:
AG001NPF
Chemical Name:
Propanamide, N-[2-[(4-hydroxyphenyl)thio]ethyl]-
CAS Number:
155196-03-5
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD03844642
IUPAC Name:
N-[2-(4-hydroxyphenyl)sulfanylethyl]propanamide
InChI:
InChI=1S/C11H15NO2S/c1-2-11(14)12-7-8-15-10-5-3-9(13)4-6-10/h3-6,13H,2,7-8H2,1H3,(H,12,14)
InChI Key:
QSZDEDWYJWMGDI-UHFFFAOYSA-N
SMILES:
CCC(=O)NCCSc1ccc(cc1)O
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.082g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.306g/mol
Monoisotopic Mass:
225.082g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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