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Home > Nitro Compounds > 141230-15-1
141230-15-1 | Ethanone, 1-[2-[(nitrobenzoyl)oxy]phenyl]- (9CI)
CAS No: 141230-15-1 Catalog No: AG001G3D MDL No:
Product Description
Catalog Number:
AG001G3D
Chemical Name:
Ethanone, 1-[2-[(nitrobenzoyl)oxy]phenyl]- (9CI)
CAS Number:
141230-15-1
Molecular Formula:
C15H11NO5
Molecular Weight:
285.2515
IUPAC Name:
(2-acetylphenyl) 2-nitrobenzoate
InChI:
InChI=1S/C15H11NO5/c1-10(17)11-6-3-5-9-14(11)21-15(18)12-7-2-4-8-13(12)16(19)20/h2-9H,1H3
InChI Key:
GDIYLFJXKRHPBN-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccccc1OC(=O)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.064g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.255g/mol
Monoisotopic Mass:
285.064g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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