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Home > Fluorides > 1373232-62-2
1373232-62-2 | Benzamide, 2-nitro-5-(trifluoromethoxy)-
CAS No: 1373232-62-2 Catalog No: AG00134M MDL No:MFCD22192357
Product Description
Catalog Number:
AG00134M
Chemical Name:
Benzamide, 2-nitro-5-(trifluoromethoxy)-
CAS Number:
1373232-62-2
Molecular Formula:
C8H5F3N2O4
Molecular Weight:
250.1315
MDL Number:
MFCD22192357
IUPAC Name:
2-nitro-5-(trifluoromethoxy)benzamide
InChI:
InChI=1S/C8H5F3N2O4/c9-8(10,11)17-4-1-2-6(13(15)16)5(3-4)7(12)14/h1-3H,(H2,12,14)
InChI Key:
ITKYUXUOGDHERZ-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc(ccc1[N+](=O)[O-])OC(F)(F)F
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.02g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.133g/mol
Monoisotopic Mass:
250.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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