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316152-14-4 | Thiophene-2-carboxylic acid (4-ethoxy-phenyl)-amide
CAS No: 316152-14-4 Catalog No: AG01F8VM MDL No:
Product Description
Catalog Number:
AG01F8VM
Chemical Name:
Thiophene-2-carboxylic acid (4-ethoxy-phenyl)-amide
CAS Number:
316152-14-4
Molecular Formula:
C13H13NO2S
Molecular Weight:
247.3128
IUPAC Name:
N-(4-ethoxyphenyl)thiophene-2-carboxamide
InChI:
InChI=1S/C13H13NO2S/c1-2-16-11-7-5-10(6-8-11)14-13(15)12-4-3-9-17-12/h3-9H,2H2,1H3,(H,14,15)
InChI Key:
UXFCUPWIXSFABY-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)NC(=O)c1cccs1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.067g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.312g/mol
Monoisotopic Mass:
247.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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