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2059947-67-8

2059947-67-8 | 4-(4-nitrophenyl)-2-azaspiro[4.4]nonan-1-one

CAS No: 2059947-67-8 Catalog No: AG01BZUS MDL No:MFCD30486872

Product Description

Catalog Number:
AG01BZUS
Chemical Name:
4-(4-nitrophenyl)-2-azaspiro[4.4]nonan-1-one
CAS Number:
2059947-67-8
Molecular Formula:
C14H16N2O3
Molecular Weight:
260.2884
MDL Number:
MFCD30486872
IUPAC Name:
4-(4-nitrophenyl)-2-azaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C14H16N2O3/c17-13-14(7-1-2-8-14)12(9-15-13)10-3-5-11(6-4-10)16(18)19/h3-6,12H,1-2,7-9H2,(H,15,17)
InChI Key:
QOYBNEVGLYAIBL-UHFFFAOYSA-N
SMILES:
O=C1NCC(C21CCCC2)c1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
377  
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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