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Home > Aldehydes > 143551-87-5
143551-87-5 | Benzaldehyde, 4-methoxy-3-(4-nitrophenoxy)-
CAS No: 143551-87-5 Catalog No: AG007JYT MDL No:
Product Description
Catalog Number:
AG007JYT
Chemical Name:
Benzaldehyde, 4-methoxy-3-(4-nitrophenoxy)-
CAS Number:
143551-87-5
Molecular Formula:
C14H11NO5
Molecular Weight:
273.2408
IUPAC Name:
4-methoxy-3-(4-nitrophenoxy)benzaldehyde
InChI:
InChI=1S/C14H11NO5/c1-19-13-7-2-10(9-16)8-14(13)20-12-5-3-11(4-6-12)15(17)18/h2-9H,1H3
InChI Key:
FSRPXKUJUHTDHF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Oc1ccc(cc1)[N+](=O)[O-])C=O
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.064g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.244g/mol
Monoisotopic Mass:
273.064g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| 4-Meth-oxy-3-(4-nitro-benz-yloxy)benzaldehyde. | Acta crystallographica. Section E, Structure reports online 20110601 |
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