Home Nitros 1-(methylsulfanyl)-3-nitrobenzene

1-(methylsulfanyl)-3-nitrobenzene

CAS No.:
2524-76-7
Catalog Number:
AG003JSH
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$44
- +
5g
95%
In Stock USA
United States
$175
- +
10g
95%
In Stock USA
United States
$263
- +
25g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003JSH
Chemical Name:
1-(methylsulfanyl)-3-nitrobenzene
CAS Number:
2524-76-7
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
MDL Number:
MFCD00024501
IUPAC Name:
1-methylsulfanyl-3-nitrobenzene
InChI:
InChI=1S/C7H7NO2S/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3
InChI Key:
GBGVXOUUXAIELM-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1)[N+](=O)[O-]
EC Number:
219-761-7
NSC Number:
53644
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.198g/mol
Monoisotopic Mass:
169.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties