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7147-77-5 | 5-(4-Nitrophenyl);furan-2-carbaldehyde
CAS No: 7147-77-5 Catalog No: AG003M6A MDL No:MFCD00124191
Product Description
Catalog Number:
AG003M6A
Chemical Name:
5-(4-Nitrophenyl);furan-2-carbaldehyde
CAS Number:
7147-77-5
Molecular Formula:
C11H7NO4
Molecular Weight:
217.1776
MDL Number:
MFCD00124191
IUPAC Name:
5-(4-nitrophenyl)furan-2-carbaldehyde
InChI:
InChI=1S/C11H7NO4/c13-7-10-5-6-11(16-10)8-1-3-9(4-2-8)12(14)15/h1-7H
InChI Key:
RTSOJVJDKNKNFU-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)c1ccc(cc1)[N+](=O)[O-]
EC Number:
230-459-4
UNII:
DO5AR91I76
NSC Number:
31431
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:
2.3
Literature
| Title | Journal |
|---|---|
| N'-[5-(4-Nitro-phen-yl)furan-2-yl-methyl-idene]-N,N-diphenyl-hydrazine. | Acta crystallographica. Section E, Structure reports online 20100801 |
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