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210158-20-6 | Morpholine, 4-[2-(4-nitrophenyl)ethyl]-
CAS No: 210158-20-6 Catalog No: AG002KLS MDL No:
Product Description
Catalog Number:
AG002KLS
Chemical Name:
Morpholine, 4-[2-(4-nitrophenyl)ethyl]-
CAS Number:
210158-20-6
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
IUPAC Name:
4-[2-(4-nitrophenyl)ethyl]morpholine
InChI:
InChI=1S/C12H16N2O3/c15-14(16)12-3-1-11(2-4-12)5-6-13-7-9-17-10-8-13/h1-4H,5-10H2
InChI Key:
GFFZFWAUXAFCSY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)CCN1CCOCC1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.271g/mol
Monoisotopic Mass:
236.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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