Home Sulfos 1-(Ethanesulfonyl)-2-methoxy-4-nitrobenzene

1-(Ethanesulfonyl)-2-methoxy-4-nitrobenzene

CAS No.:
75259-32-4
Catalog Number:
AG00G9MW
Molecular Formula:
C9H11NO5S
Molecular Weight:
245.2523
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$100
- +
5g
98%
In Stock USA
United States
$300
- +
25g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00G9MW
Chemical Name:
1-(Ethanesulfonyl)-2-methoxy-4-nitrobenzene
CAS Number:
75259-32-4
Molecular Formula:
C9H11NO5S
Molecular Weight:
245.2523
MDL Number:
MFCD25953911
IUPAC Name:
1-ethylsulfonyl-2-methoxy-4-nitrobenzene
InChI:
InChI=1S/C9H11NO5S/c1-3-16(13,14)9-5-4-7(10(11)12)6-8(9)15-2/h4-6H,3H2,1-2H3
InChI Key:
LMNQJZKCGQWBHB-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1S(=O)(=O)CC)[N+](=O)[O-]
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.036g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.249g/mol
Monoisotopic Mass:
245.036g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties