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2060008-07-1

2060008-07-1 | 3-(3-nitrophenyl)-1,2-oxazole-5-sulfonyl chloride

CAS No: 2060008-07-1 Catalog No: AG01BWAT MDL No:MFCD30476954

Product Description

Catalog Number:
AG01BWAT
Chemical Name:
3-(3-nitrophenyl)-1,2-oxazole-5-sulfonyl chloride
CAS Number:
2060008-07-1
Molecular Formula:
C9H5ClN2O5S
Molecular Weight:
288.6644
MDL Number:
MFCD30476954
IUPAC Name:
3-(3-nitrophenyl)-1,2-oxazole-5-sulfonyl chloride
InChI:
InChI=1S/C9H5ClN2O5S/c10-18(15,16)9-5-8(11-17-9)6-2-1-3-7(4-6)12(13)14/h1-5H
InChI Key:
CANVRUJPZBGMGS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1noc(c1)S(=O)(=O)Cl

Properties

Complexity:
418  
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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