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10185-62-3 | Benzenesulfonyl chloride, 3-(5-methyl-1,2,4-oxadiazol-3-yl)-
CAS No: 10185-62-3 Catalog No: AG0005PU MDL No:MFCD06797486
Product Description
Catalog Number:
AG0005PU
Chemical Name:
Benzenesulfonyl chloride, 3-(5-methyl-1,2,4-oxadiazol-3-yl)-
CAS Number:
10185-62-3
Molecular Formula:
C9H7ClN2O3S
Molecular Weight:
258.6815
MDL Number:
MFCD06797486
IUPAC Name:
3-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl chloride
InChI:
InChI=1S/C9H7ClN2O3S/c1-6-11-9(12-15-6)7-3-2-4-8(5-7)16(10,13)14/h2-5H,1H3
InChI Key:
YPMVPGZXUILSPT-UHFFFAOYSA-N
SMILES:
Cc1onc(n1)c1cccc(c1)S(=O)(=O)Cl
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.987g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.676g/mol
Monoisotopic Mass:
257.987g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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