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Home > Nitro Compounds > 1909337-76-3
1909337-76-3 | 3-(4-nitrophenyl)-1,2-oxazole-5-sulfonyl chloride
CAS No: 1909337-76-3 Catalog No: AG01C5JI MDL No:MFCD29763435
Product Description
Catalog Number:
AG01C5JI
Chemical Name:
3-(4-nitrophenyl)-1,2-oxazole-5-sulfonyl chloride
CAS Number:
1909337-76-3
Molecular Formula:
C9H5ClN2O5S
Molecular Weight:
288.6644
MDL Number:
MFCD29763435
IUPAC Name:
3-(4-nitrophenyl)-1,2-oxazole-5-sulfonyl chloride
InChI:
InChI=1S/C9H5ClN2O5S/c10-18(15,16)9-5-8(11-17-9)6-1-3-7(4-2-6)12(13)14/h1-5H
InChI Key:
BTNNGVAJVKAKAP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)c1noc(c1)S(=O)(=O)Cl
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.961g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.658g/mol
Monoisotopic Mass:
287.961g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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