Home Nitros 1-[(4-nitrophenyl)methyl]piperidine-2,6-dione

1-[(4-nitrophenyl)methyl]piperidine-2,6-dione

CAS No.:
1461708-55-3
Catalog Number:
AG01A6TL
Molecular Formula:
C12H12N2O4
Molecular Weight:
248.2347
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Product Description
Catalog Number:
AG01A6TL
Chemical Name:
1-[(4-nitrophenyl)methyl]piperidine-2,6-dione
CAS Number:
1461708-55-3
Molecular Formula:
C12H12N2O4
Molecular Weight:
248.2347
MDL Number:
MFCD25970430
IUPAC Name:
1-[(4-nitrophenyl)methyl]piperidine-2,6-dione
InChI:
InChI=1S/C12H12N2O4/c15-11-2-1-3-12(16)13(11)8-9-4-6-10(7-5-9)14(17)18/h4-7H,1-3,8H2
InChI Key:
FRAGOVMVAASSOM-UHFFFAOYSA-N
SMILES:
O=C1CCCC(=O)N1Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.08g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.238g/mol
Monoisotopic Mass:
248.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties