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2060008-01-5 | 3-(4-ethoxyphenyl)-1,2-oxazole-5-sulfonyl chloride
CAS No: 2060008-01-5 Catalog No: AG01BWAE MDL No:MFCD30476939
Product Description
Catalog Number:
AG01BWAE
Chemical Name:
3-(4-ethoxyphenyl)-1,2-oxazole-5-sulfonyl chloride
CAS Number:
2060008-01-5
Molecular Formula:
C11H10ClNO4S
Molecular Weight:
287.7194
MDL Number:
MFCD30476939
IUPAC Name:
3-(4-ethoxyphenyl)-1,2-oxazole-5-sulfonyl chloride
InChI:
InChI=1S/C11H10ClNO4S/c1-2-16-9-5-3-8(4-6-9)10-7-11(17-13-10)18(12,14)15/h3-7H,2H2,1H3
InChI Key:
UPXAKFQXHGKZKG-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)c1noc(c1)S(=O)(=O)Cl
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.002g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.714g/mol
Monoisotopic Mass:
287.002g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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