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Home > Nitro Compounds > 2059941-31-8
2059941-31-8 | 4-(2-nitrophenyl)-2-azaspiro[4.4]nonan-1-one
CAS No: 2059941-31-8 Catalog No: AG01BZUY MDL No:MFCD30486878
Product Description
Catalog Number:
AG01BZUY
Chemical Name:
4-(2-nitrophenyl)-2-azaspiro[4.4]nonan-1-one
CAS Number:
2059941-31-8
Molecular Formula:
C14H16N2O3
Molecular Weight:
260.2884
MDL Number:
MFCD30486878
IUPAC Name:
4-(2-nitrophenyl)-2-azaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C14H16N2O3/c17-13-14(7-3-4-8-14)11(9-15-13)10-5-1-2-6-12(10)16(18)19/h1-2,5-6,11H,3-4,7-9H2,(H,15,17)
InChI Key:
HHPKNTKRERNUPC-UHFFFAOYSA-N
SMILES:
O=C1NCC(C21CCCC2)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.293g/mol
Monoisotopic Mass:
260.116g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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