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66961-19-1 | 2-(2-NITROPHENOXY)BENZALDEHYDE
CAS No: 66961-19-1 Catalog No: AG0064RU MDL No:MFCD00156891
Product Description
Catalog Number:
AG0064RU
Chemical Name:
2-(2-NITROPHENOXY)BENZALDEHYDE
CAS Number:
66961-19-1
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
MDL Number:
MFCD00156891
IUPAC Name:
2-(2-nitrophenoxy)benzaldehyde
InChI:
InChI=1S/C13H9NO4/c15-9-10-5-1-3-7-12(10)18-13-8-4-2-6-11(13)14(16)17/h1-9H
InChI Key:
GJXQFZNGTPPSPV-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1Oc1ccccc1[N+](=O)[O-]
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.053g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.218g/mol
Monoisotopic Mass:
243.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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