Home Nitros 2-(tert-butylsulfanyl)-1,3-difluoro-5-nitrobenzene

2-(tert-butylsulfanyl)-1,3-difluoro-5-nitrobenzene

CAS No.:
1864016-58-9
Catalog Number:
AG01AP0H
Molecular Formula:
C10H11F2NO2S
Molecular Weight:
247.2616
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AP0H
Chemical Name:
2-(tert-butylsulfanyl)-1,3-difluoro-5-nitrobenzene
CAS Number:
1864016-58-9
Molecular Formula:
C10H11F2NO2S
Molecular Weight:
247.2616
MDL Number:
MFCD29034352
IUPAC Name:
2-tert-butylsulfanyl-1,3-difluoro-5-nitrobenzene
InChI:
InChI=1S/C10H11F2NO2S/c1-10(2,3)16-9-7(11)4-6(13(14)15)5-8(9)12/h4-5H,1-3H3
InChI Key:
HFKOZPDPMIQBDK-UHFFFAOYSA-N
SMILES:
CC(Sc1c(F)cc(cc1F)[N+](=O)[O-])(C)C
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.048g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.26g/mol
Monoisotopic Mass:
247.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties