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Home > Nitro Compounds > 26378-36-9
26378-36-9 | Oxaziridine, 2-(1,1-dimethylethyl)-3-(4-nitrophenyl)-
CAS No: 26378-36-9 Catalog No: AG002SY0 MDL No:
Product Description
Catalog Number:
AG002SY0
Chemical Name:
Oxaziridine, 2-(1,1-dimethylethyl)-3-(4-nitrophenyl)-
CAS Number:
26378-36-9
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
IUPAC Name:
2-tert-butyl-3-(4-nitrophenyl)oxaziridine
InChI:
InChI=1S/C11H14N2O3/c1-11(2,3)12-10(16-12)8-4-6-9(7-5-8)13(14)15/h4-7,10H,1-3H3
InChI Key:
IWSSKZLNQFPBFL-UHFFFAOYSA-N
SMILES:
CC(N1OC1c1ccc(cc1)[N+](=O)[O-])(C)C
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.244g/mol
Monoisotopic Mass:
222.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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