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14052-72-3 | 5-Nitro-2-furaldehyde 4,4-diethyl thiosemicarbazone
CAS No: 14052-72-3 Catalog No: AG00AJOD MDL No:
Product Description
Catalog Number:
AG00AJOD
Chemical Name:
5-Nitro-2-furaldehyde 4,4-diethyl thiosemicarbazone
CAS Number:
14052-72-3
IUPAC Name:
1,1-diethyl-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea
InChI:
InChI=1S/C10H14N4O3S/c1-3-13(4-2)10(18)12-11-7-8-5-6-9(17-8)14(15)16/h5-7H,3-4H2,1-2H3,(H,12,18)/b11-7+
InChI Key:
AXOKQUITRHIXGR-YRNVUSSQSA-N
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
270.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.307g/mol
Monoisotopic Mass:
270.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Antibacterial nitrofuran derivatives. I. 5-nitro-2-furaldehyde semicarbazones and thiosemicarbazones. | Journal of medicinal chemistry 19670701 |
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