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2059998-81-9 | 3-(3-methoxyphenyl)-1,2-oxazole-5-sulfonyl chloride
CAS No: 2059998-81-9 Catalog No: AG01BWAI MDL No:MFCD30476943
Product Description
Catalog Number:
AG01BWAI
Chemical Name:
3-(3-methoxyphenyl)-1,2-oxazole-5-sulfonyl chloride
CAS Number:
2059998-81-9
Molecular Formula:
C10H8ClNO4S
Molecular Weight:
273.6928
MDL Number:
MFCD30476943
IUPAC Name:
3-(3-methoxyphenyl)-1,2-oxazole-5-sulfonyl chloride
InChI:
InChI=1S/C10H8ClNO4S/c1-15-8-4-2-3-7(5-8)9-6-10(16-12-9)17(11,13)14/h2-6H,1H3
InChI Key:
NZOJNJWFUJJNHR-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)c1noc(c1)S(=O)(=O)Cl
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.986g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.687g/mol
Monoisotopic Mass:
272.986g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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