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66369-58-2 | Furancarboxaldehyde, (4-nitrophenyl)-
CAS No: 66369-58-2 Catalog No: AG006MSP MDL No:
Product Description
Catalog Number:
AG006MSP
Chemical Name:
Furancarboxaldehyde, (4-nitrophenyl)-
CAS Number:
66369-58-2
Molecular Formula:
C11H7NO4
Molecular Weight:
217.1776
IUPAC Name:
3-(4-nitrophenyl)furan-2-carbaldehyde
InChI:
InChI=1S/C11H7NO4/c13-7-11-10(5-6-16-11)8-1-3-9(4-2-8)12(14)15/h1-7H
InChI Key:
QJOIWBJNUQLUED-UHFFFAOYSA-N
SMILES:
O=Cc1occc1c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.038g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.18g/mol
Monoisotopic Mass:
217.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Studies on nitrophenylfuran derivatives part Xii. synthesis, characterization, antibacterial and antiviral activities of some nitrophenylfurfurylidene-1,2,4-triazolo[3,4-b]-1,3,4-thiadiazines. | Farmaco (Societa chimica italiana : 1989) 20011201 |
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