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Home Aldehydes 2-Methyl-1H-imidazole-4-carbaldehyde

2-Methyl-1H-imidazole-4-carbaldehyde

CAS No.:
35034-22-1
Catalog Number:
AG007GFM
Molecular Formula:
C5H6N2O
Molecular Weight:
110.1139
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$350
- +
25g
97%
In Stock USA
United States
$1182
- +
100g
97%
In Stock USA
United States
$4000
- +
Product Description
Catalog Number:
AG007GFM
Chemical Name:
2-Methyl-1H-imidazole-4-carbaldehyde
CAS Number:
35034-22-1
Molecular Formula:
C5H6N2O
Molecular Weight:
110.1139
MDL Number:
MFCD00173725
IUPAC Name:
2-methyl-1H-imidazole-5-carbaldehyde
InChI:
InChI=1S/C5H6N2O/c1-4-6-2-5(3-8)7-4/h2-3H,1H3,(H,6,7)
InChI Key:
ZWULFIBGPXWGFG-UHFFFAOYSA-N
SMILES:
Cc1ncc([nH]1)C=O
Properties
Complexity:
94.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.048g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
110.116g/mol
Monoisotopic Mass:
110.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
One-dimensional spin-crossover Iron(II) complexes bridged by intermolecular imidazole-pyridine NH...N hydrogen bonds, [Fe(HL(Me))(3)]X(2) (HL(Me) = (2-methylimidazol-4-yl-methylideneamino-2-ethylpyridine; X = PF(6), ClO(4), BF(4)). Inorganic chemistry 20100215
One-step and two-step spin-crossover iron(II) complexes of ((2-methylimidazol-4-yl)methylidene)histamine. Inorganic chemistry 20090803
Properties