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Home > Nitro Compounds > 114717-12-3
114717-12-3 | Bicyclo[2.2.1]heptan-2-imine, 1,7,7-trimethyl-N-nitro-, (1R,4R)-
CAS No: 114717-12-3 Catalog No: AG000F3N MDL No:
Product Description
Catalog Number:
AG000F3N
Chemical Name:
Bicyclo[2.2.1]heptan-2-imine, 1,7,7-trimethyl-N-nitro-, (1R,4R)-
CAS Number:
114717-12-3
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
IUPAC Name:
N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene)nitramide
InChI:
InChI=1S/C10H16N2O2/c1-9(2)7-4-5-10(9,3)8(6-7)11-12(13)14/h7H,4-6H2,1-3H3
InChI Key:
QWPYVYJPIHGYGX-UHFFFAOYSA-N
SMILES:
C[C@]12CC[C@@H](C2(C)C)CC1=N[N+](=O)[O-]
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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