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37543-50-3 | 3-phenyl-1,2-oxazole-5-sulfonyl chloride
CAS No: 37543-50-3 Catalog No: AG01C3XE MDL No:MFCD19200321
Product Description
Catalog Number:
AG01C3XE
Chemical Name:
3-phenyl-1,2-oxazole-5-sulfonyl chloride
CAS Number:
37543-50-3
Molecular Formula:
C9H6ClNO3S
Molecular Weight:
243.6668
MDL Number:
MFCD19200321
IUPAC Name:
3-phenyl-1,2-oxazole-5-sulfonyl chloride
InChI:
InChI=1S/C9H6ClNO3S/c10-15(12,13)9-6-8(11-14-9)7-4-2-1-3-5-7/h1-6H
InChI Key:
NCKNGGKOOAPRLL-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1onc(c1)c1ccccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.976g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.661g/mol
Monoisotopic Mass:
242.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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