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Home Sulfos 3-Nitrobenzenesulfonyl chloride

3-Nitrobenzenesulfonyl chloride

CAS No.:
121-51-7
Catalog Number:
AG007Q5Y
Molecular Formula:
C6H4ClNO4S
Molecular Weight:
221.6183
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
95%
In Stock USA
United States
$38
- +
100g
95%
In Stock USA
United States
$125
- +
500g
95%
In Stock USA
United States
$547
- +
Product Description
Catalog Number:
AG007Q5Y
Chemical Name:
3-Nitrobenzenesulfonyl chloride
CAS Number:
121-51-7
Molecular Formula:
C6H4ClNO4S
Molecular Weight:
221.6183
MDL Number:
MFCD00007435
IUPAC Name:
3-nitrobenzenesulfonyl chloride
InChI:
InChI=1S/C6H4ClNO4S/c7-13(11,12)6-3-1-2-5(4-6)8(9)10/h1-4H
InChI Key:
MWWNNNAOGWPTQY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)S(=O)(=O)Cl
EC Number:
204-476-2
UNII:
KN1Z8WPL9U
NSC Number:
9806
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.955g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.611g/mol
Monoisotopic Mass:
220.955g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Methyl (R)-2-(2-chloro-phen-yl)-2-(3-nitro-phenyl-sulfon-yloxy)acetate. Acta crystallographica. Section E, Structure reports online 20120601
Properties