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1427380-74-2 | 2-methyl-5-phenyl-1,3-oxazole-4-sulfonyl chloride
CAS No: 1427380-74-2 Catalog No: AG00VVP6 MDL No:MFCD23143997
Product Description
Catalog Number:
AG00VVP6
Chemical Name:
2-methyl-5-phenyl-1,3-oxazole-4-sulfonyl chloride
CAS Number:
1427380-74-2
Molecular Formula:
C10H8ClNO3S
Molecular Weight:
257.6934
MDL Number:
MFCD23143997
IUPAC Name:
2-methyl-5-phenyl-1,3-oxazole-4-sulfonyl chloride
InChI:
InChI=1S/C10H8ClNO3S/c1-7-12-10(16(11,13)14)9(15-7)8-5-3-2-4-6-8/h2-6H,1H3
InChI Key:
ROODCHXNTOMKDI-UHFFFAOYSA-N
SMILES:
Cc1oc(c(n1)S(=O)(=O)Cl)c1ccccc1
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.991g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.688g/mol
Monoisotopic Mass:
256.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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