Home Nitros 1-[(4-Bromophenyl)sulfanyl]-4-nitrobenzene

1-[(4-Bromophenyl)sulfanyl]-4-nitrobenzene

CAS No.:
21969-12-0
Catalog Number:
AG00BIFK
Molecular Formula:
C12H8BrNO2S
Molecular Weight:
310.1664
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$57
- +
10g
98%
In Stock USA
United States
$100
- +
25g
98%
In Stock USA
United States
$200
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00BIFK
Chemical Name:
1-[(4-Bromophenyl)sulfanyl]-4-nitrobenzene
CAS Number:
21969-12-0
Molecular Formula:
C12H8BrNO2S
Molecular Weight:
310.1664
MDL Number:
MFCD00172327
IUPAC Name:
1-(4-bromophenyl)sulfanyl-4-nitrobenzene
InChI:
InChI=1S/C12H8BrNO2S/c13-9-1-5-11(6-2-9)17-12-7-3-10(4-8-12)14(15)16/h1-8H
InChI Key:
XWPBPDJTKDECOY-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)Sc1ccc(cc1)[N+](=O)[O-]
NSC Number:
149667
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.946g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.165g/mol
Monoisotopic Mass:
308.946g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties