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88124-14-5

88124-14-5 | Butanamide, N-[2-(ethylsulfonyl)ethyl]-3-oxo-

CAS No: 88124-14-5 Catalog No: AG004IGB MDL No:

Product Description

Catalog Number:
AG004IGB
Chemical Name:
Butanamide, N-[2-(ethylsulfonyl)ethyl]-3-oxo-
CAS Number:
88124-14-5
Molecular Formula:
C8H15NO4S
Molecular Weight:
221.2740
IUPAC Name:
N-(2-ethylsulfonylethyl)-3-oxobutanamide
InChI:
InChI=1S/C8H15NO4S/c1-3-14(12,13)5-4-9-8(11)6-7(2)10/h3-6H2,1-2H3,(H,9,11)
InChI Key:
NEVZUOGFAWCCAE-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)CCNC(=O)CC(=O)C

Properties

Complexity:
302  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.072g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.271g/mol
Monoisotopic Mass:
221.072g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  

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