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Home > Nitro Compounds > 903796-25-8
903796-25-8 | 3-nitro-N-(2-phenoxyethyl)benzamide
CAS No: 903796-25-8 Catalog No: AG00JH8R MDL No:MFCD05611305
Product Description
Catalog Number:
AG00JH8R
Chemical Name:
3-nitro-N-(2-phenoxyethyl)benzamide
CAS Number:
903796-25-8
Molecular Formula:
C15H14N2O4
Molecular Weight:
286.2827
MDL Number:
MFCD05611305
IUPAC Name:
3-nitro-N-(2-phenoxyethyl)benzamide
InChI:
InChI=1S/C15H14N2O4/c18-15(12-5-4-6-13(11-12)17(19)20)16-9-10-21-14-7-2-1-3-8-14/h1-8,11H,9-10H2,(H,16,18)
InChI Key:
GVRKQIOMMSDQIS-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)[N+](=O)[O-])NCCOc1ccccc1
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.287g/mol
Monoisotopic Mass:
286.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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