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Home > Nitro Compounds > 88090-53-3
88090-53-3 | Benzene, 1-[(3-cyclohexen-1-ylmethyl)seleno]-2-nitro-
CAS No: 88090-53-3 Catalog No: AG004K06 MDL No:
Product Description
Catalog Number:
AG004K06
Chemical Name:
Benzene, 1-[(3-cyclohexen-1-ylmethyl)seleno]-2-nitro-
CAS Number:
88090-53-3
Molecular Formula:
C13H15NO2Se
Molecular Weight:
296.2237
IUPAC Name:
1-(cyclohex-3-en-1-ylmethylselanyl)-2-nitrobenzene
InChI:
InChI=1S/C13H15NO2Se/c15-14(16)12-8-4-5-9-13(12)17-10-11-6-2-1-3-7-11/h1-2,4-5,8-9,11H,3,6-7,10H2
InChI Key:
MVOPDRKKZWDARE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1[Se]CC1CCC=CC1
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.027g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.239g/mol
Monoisotopic Mass:
297.027g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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