Home Sulfos methyl 5-(chlorosulfonyl)-1,2-oxazole-3-carboxylate

methyl 5-(chlorosulfonyl)-1,2-oxazole-3-carboxylate

CAS No.:
1909326-52-8
Catalog Number:
AG01AMTK
Molecular Formula:
C5H4ClNO5S
Molecular Weight:
225.6070
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Product Description
Catalog Number:
AG01AMTK
Chemical Name:
methyl 5-(chlorosulfonyl)-1,2-oxazole-3-carboxylate
CAS Number:
1909326-52-8
Molecular Formula:
C5H4ClNO5S
Molecular Weight:
225.6070
MDL Number:
MFCD29054844
IUPAC Name:
methyl 5-chlorosulfonyl-1,2-oxazole-3-carboxylate
InChI:
InChI=1S/C5H4ClNO5S/c1-11-5(8)3-2-4(12-7-3)13(6,9)10/h2H,1H3
InChI Key:
JEVCRQSSHAJMFH-UHFFFAOYSA-N
SMILES:
COC(=O)c1noc(c1)S(=O)(=O)Cl
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.95g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.599g/mol
Monoisotopic Mass:
224.95g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties