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Home > Nitro Compounds > 19281-20-0
19281-20-0 | Ethanone, 1-(4-morpholinyl)-2-(3-nitrophenyl)-
CAS No: 19281-20-0 Catalog No: AG002GCR MDL No:
Product Description
Catalog Number:
AG002GCR
Chemical Name:
Ethanone, 1-(4-morpholinyl)-2-(3-nitrophenyl)-
CAS Number:
19281-20-0
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
IUPAC Name:
1-morpholin-4-yl-2-(3-nitrophenyl)ethanone
InChI:
InChI=1S/C12H14N2O4/c15-12(13-4-6-18-7-5-13)9-10-2-1-3-11(8-10)14(16)17/h1-3,8H,4-7,9H2
InChI Key:
YCLQRUDKGXDPHJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCOCC1)Cc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.254g/mol
Monoisotopic Mass:
250.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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