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Home > Nitro Compounds > 113844-46-5
113844-46-5 | 3H-2,1-Benzoxaselenol-3-one, 7-nitro-
CAS No: 113844-46-5 Catalog No: AG0009V4 MDL No:
Product Description
Catalog Number:
AG0009V4
Chemical Name:
3H-2,1-Benzoxaselenol-3-one, 7-nitro-
CAS Number:
113844-46-5
Molecular Formula:
C7H3NO4Se
Molecular Weight:
244.0630
IUPAC Name:
7-nitro-2,1-benzoxaselenol-3-one
InChI:
InChI=1S/C7H3NO4Se/c9-7-4-2-1-3-5(8(10)11)6(4)13-12-7/h1-3H
InChI Key:
QWNQONSVENVHST-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1[se]oc2=O
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.923g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.075g/mol
Monoisotopic Mass:
244.923g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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