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713-65-5 | 1-Nitro-4-(trifluoromethoxy)benzene
CAS No: 713-65-5 Catalog No: AG003KB6 MDL No:MFCD00040302
Product Description
Catalog Number:
AG003KB6
Chemical Name:
1-Nitro-4-(trifluoromethoxy)benzene
CAS Number:
713-65-5
Molecular Formula:
C7H4F3NO3
Molecular Weight:
207.1068
MDL Number:
MFCD00040302
IUPAC Name:
1-nitro-4-(trifluoromethoxy)benzene
InChI:
InChI=1S/C7H4F3NO3/c8-7(9,10)14-6-3-1-5(2-4-6)11(12)13/h1-4H
InChI Key:
UBEIKVUMDBCCRW-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1)[N+](=O)[O-])(F)F
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.014g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.108g/mol
Monoisotopic Mass:
207.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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