Home Sulfos 2-Pyridinecarboxylic acid, 5-(ethylsulfonyl)-, ethyl ester

2-Pyridinecarboxylic acid, 5-(ethylsulfonyl)-, ethyl ester

CAS No.:
1314406-40-0
Catalog Number:
AG000W7C
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
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Product Description
Catalog Number:
AG000W7C
Chemical Name:
2-Pyridinecarboxylic acid, 5-(ethylsulfonyl)-, ethyl ester
CAS Number:
1314406-40-0
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
MDL Number:
MFCD19442771
IUPAC Name:
ethyl 5-ethylsulfonylpyridine-2-carboxylate
InChI:
InChI=1S/C10H13NO4S/c1-3-15-10(12)9-6-5-8(7-11-9)16(13,14)4-2/h5-7H,3-4H2,1-2H3
InChI Key:
SIHIRPBCEHQTAU-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cn1)S(=O)(=O)CC
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.277g/mol
Monoisotopic Mass:
243.057g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties