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Home > Nitro Compounds > 89303-60-6
89303-60-6 | Morpholine, 4-[[(4-nitrophenyl)phenylmethyl]sulfonyl]-
CAS No: 89303-60-6 Catalog No: AG003YMT MDL No:
Product Description
Catalog Number:
AG003YMT
Chemical Name:
Morpholine, 4-[[(4-nitrophenyl)phenylmethyl]sulfonyl]-
CAS Number:
89303-60-6
Molecular Formula:
C17H18N2O5S
Molecular Weight:
362.4002
IUPAC Name:
4-[(4-nitrophenyl)-phenylmethyl]sulfonylmorpholine
InChI:
InChI=1S/C17H18N2O5S/c20-19(21)16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)25(22,23)18-10-12-24-13-11-18/h1-9,17H,10-13H2
InChI Key:
JDOPZORVHYJJSM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C(S(=O)(=O)N1CCOCC1)c1ccccc1
Properties
Complexity:
536
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.094g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.4g/mol
Monoisotopic Mass:
362.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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