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Home > Nitro Compounds > 331869-81-9
331869-81-9 | 2-(4-Benzyloxy-phenoxy)-N-(4-nitro-phenyl)-acetamide
CAS No: 331869-81-9 Catalog No: AG01EUZI MDL No:
Product Description
Catalog Number:
AG01EUZI
Chemical Name:
2-(4-Benzyloxy-phenoxy)-N-(4-nitro-phenyl)-acetamide
CAS Number:
331869-81-9
Molecular Formula:
C21H18N2O5
Molecular Weight:
378.3780
IUPAC Name:
N-(4-nitrophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
InChI:
InChI=1S/C21H18N2O5/c24-21(22-17-6-8-18(9-7-17)23(25)26)15-28-20-12-10-19(11-13-20)27-14-16-4-2-1-3-5-16/h1-13H,14-15H2,(H,22,24)
InChI Key:
ZOJHNWMPYCTBJR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)[N+](=O)[O-])COc1ccc(cc1)OCc1ccccc1
Properties
Complexity:
488
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.122g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
378.384g/mol
Monoisotopic Mass:
378.122g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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