Home Other Building Blocks 2-TETRAFLUOROETHOXY-5-NITROTOLUENE

2-TETRAFLUOROETHOXY-5-NITROTOLUENE

CAS No.:
28202-30-4
Catalog Number:
AG00C16C
Molecular Formula:
C9H7F4NO3
Molecular Weight:
253.1504
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Product Description
Catalog Number:
AG00C16C
Chemical Name:
2-TETRAFLUOROETHOXY-5-NITROTOLUENE
CAS Number:
28202-30-4
Molecular Formula:
C9H7F4NO3
Molecular Weight:
253.1504
MDL Number:
MFCD00047716
IUPAC Name:
2-methyl-4-nitro-1-(1,1,2,2-tetrafluoroethoxy)benzene
InChI:
InChI=1S/C9H7F4NO3/c1-5-4-6(14(15)16)2-3-7(5)17-9(12,13)8(10)11/h2-4,8H,1H3
InChI Key:
JHPMFMSCHNLTQM-UHFFFAOYSA-N
SMILES:
FC(C(Oc1ccc(cc1C)[N+](=O)[O-])(F)F)F
EC Number:
248-896-4
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.036g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.153g/mol
Monoisotopic Mass:
253.036g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties