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3034-50-2 | 1H-Imidazole-5-carboxaldehyde
CAS No: 3034-50-2 Catalog No: AG002ZTB MDL No:MFCD00173726
Product Description
Catalog Number:
AG002ZTB
Chemical Name:
1H-Imidazole-5-carboxaldehyde
CAS Number:
3034-50-2
Molecular Formula:
C4H4N2O
Molecular Weight:
96.0874
MDL Number:
MFCD00173726
IUPAC Name:
1H-imidazole-5-carbaldehyde
InChI:
InChI=1S/C4H4N2O/c7-2-4-1-5-3-6-4/h1-3H,(H,5,6)
InChI Key:
ZQEXIXXJFSQPNA-UHFFFAOYSA-N
SMILES:
O=Cc1cnc[nH]1
EC Number:
221-227-3
NSC Number:
400521
Properties
Complexity:
74.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
96.032g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
96.089g/mol
Monoisotopic Mass:
96.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Unprecedented 'In Water' imidazole carbonylation: paradigm shift for preparation of urea and carbamate. | Organic letters 20120601 |
| A high-symmetry coordination cage from 38- or 62-component self-assembly. | Journal of the American Chemical Society 20120516 |
| Syntheses of aliphatic polycarbonates from 2'-deoxyribonucleosides. | Biomacromolecules 20110509 |
| Conformationally constrained histidines in the design of peptidomimetics: strategies for the χ-space control. | International journal of molecular sciences 20110101 |
| Effect of multifold charge groups and imidazole-4-carboxaldehyde on physicochemical characteristics and transfection of cationic polyphosphazenes/DNA complexes. | International journal of pharmaceutics 20100510 |
| Fluorescent protein red Kaede chromophore; one-step, high-yield synthesis and potential application for solar cells. | Chemical communications (Cambridge, England) 20091207 |
| Structures and spin states of bis(tridentate)-type mononuclear and triple helicate dinuclear iron(II) complexes of imidazole-4-carbaldehyde azine. | Inorganic chemistry 20090921 |
| Synthesis and anti-breast cancer activities of substituted quinolines. | Bioorganic & medicinal chemistry letters 20080601 |
| Chiral recognition and conglomerate crystallization induced by self-organization of cobalt(III) complexes of a tripodal ligand containing three imidazole groups. | Inorganic chemistry 20071001 |
| Synthesis and characterization of seven-coordinate tripodal imidazole complexes of iron(II) and manganese(II). | Dalton transactions (Cambridge, England : 2003) 20051121 |
| Supramolecular spin-crossover iron complexes based on imidazole-imidazolate hydrogen bonds. | Inorganic chemistry 20040712 |
| Suppression of different phases of systemic contact hypersensitivity by urocanic acid oxidation products. | Photochemistry and photobiology 20040101 |
| Potential inhibitors of angiogenesis. Part II: 3-(azolylmethylene)-2,3-dihydrobenzo[b]furan-2-ones. | Journal of enzyme inhibition and medicinal chemistry 20030601 |
| Photo amidoglycosylation of an allal azidoformate. Synthesis of beta-2-amido allopyranosides. | Organic letters 20010208 |
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