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1698589-38-6 | N-[(1,2-oxazol-5-yl)methyl]methanesulfonamide
CAS No: 1698589-38-6 Catalog No: AG01BVOW MDL No:MFCD30497605
Product Description
Catalog Number:
AG01BVOW
Chemical Name:
N-[(1,2-oxazol-5-yl)methyl]methanesulfonamide
CAS Number:
1698589-38-6
Molecular Formula:
C5H8N2O3S
Molecular Weight:
176.1936
MDL Number:
MFCD30497605
IUPAC Name:
N-(1,2-oxazol-5-ylmethyl)methanesulfonamide
InChI:
InChI=1S/C5H8N2O3S/c1-11(8,9)7-4-5-2-3-6-10-5/h2-3,7H,4H2,1H3
InChI Key:
LCLZLZKOVINVME-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)NCc1ccno1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.026g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.19g/mol
Monoisotopic Mass:
176.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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