Home Sulfos 1-[(Ethanesulfonyl)methyl]-4-nitrobenzene

1-[(Ethanesulfonyl)methyl]-4-nitrobenzene

CAS No.:
1612-41-5
Catalog Number:
AG00HYNG
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
10g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00HYNG
Chemical Name:
1-[(Ethanesulfonyl)methyl]-4-nitrobenzene
CAS Number:
1612-41-5
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
MDL Number:
MFCD22054831
IUPAC Name:
1-(ethylsulfonylmethyl)-4-nitrobenzene
InChI:
InChI=1S/C9H11NO4S/c1-2-15(13,14)7-8-3-5-9(6-4-8)10(11)12/h3-6H,2,7H2,1H3
InChI Key:
QRLVYWVPKPUBJJ-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.25g/mol
Monoisotopic Mass:
229.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties