Home Nitros 1-(1,1-Difluoroethyl)-2-nitrobenzene

1-(1,1-Difluoroethyl)-2-nitrobenzene

CAS No.:
57554-57-1
Catalog Number:
AG00ELZ3
Molecular Formula:
C8H7F2NO2
Molecular Weight:
187.1435
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00ELZ3
Chemical Name:
1-(1,1-Difluoroethyl)-2-nitrobenzene
CAS Number:
57554-57-1
Molecular Formula:
C8H7F2NO2
Molecular Weight:
187.1435
MDL Number:
MFCD14525558
IUPAC Name:
1-(1,1-difluoroethyl)-2-nitrobenzene
InChI:
InChI=1S/C8H7F2NO2/c1-8(9,10)6-4-2-3-5-7(6)11(12)13/h2-5H,1H3
InChI Key:
WAATWIWRTPMVAU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1C(F)(F)C
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.044g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.146g/mol
Monoisotopic Mass:
187.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties