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Home Halogens 2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde

2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde

CAS No.:
83857-96-9
Catalog Number:
AG003GTP
Molecular Formula:
C8H11ClN2O
Molecular Weight:
186.6387
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10g
95%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
500g
98%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG003GTP
Chemical Name:
2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde
CAS Number:
83857-96-9
Molecular Formula:
C8H11ClN2O
Molecular Weight:
186.6387
MDL Number:
MFCD01934396
IUPAC Name:
2-butyl-5-chloro-1H-imidazole-4-carbaldehyde
InChI:
InChI=1S/C8H11ClN2O/c1-2-3-4-7-10-6(5-12)8(9)11-7/h5H,2-4H2,1H3,(H,10,11)
InChI Key:
JLVIHQCWASNXCK-UHFFFAOYSA-N
SMILES:
CCCCc1nc(c([nH]1)Cl)C=O
UNII:
7H170U0SWE
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.056g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.639g/mol
Monoisotopic Mass:
186.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Synthesis and antimicrobial activity of N'-heteroarylidene-1-adamantylcarbohydrazides and (±)-2-(1-adamantyl)-4-acetyl-5-[5-(4-substituted phenyl-3-isoxazolyl)]-1,3,4-oxadiazolines. Molecules (Basel, Switzerland) 20120316
N-Substituted-2-butyl-5-chloro-3H-imidazole-4-carbaldehyde derivatives as anti-tumor agents against Ehrlich ascites tumor cells in vivo. Medicinal chemistry (Shariqah (United Arab Emirates)) 20070501
Novel delta2-isoxazolines as group II phospholipase A2 inhibitors. Bioorganic & medicinal chemistry letters 20040716
Properties