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118001-71-1

118001-71-1 | 4-[(1-METHYL-1H-IMIDAZOL-2-YL)METHOXY]BENZALDEHYDE

CAS No: 118001-71-1 Catalog No: AG008XYO MDL No:MFCD05863357

Product Description

Catalog Number:
AG008XYO
Chemical Name:
4-[(1-METHYL-1H-IMIDAZOL-2-YL)METHOXY]BENZALDEHYDE
CAS Number:
118001-71-1
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD05863357
IUPAC Name:
4-[(1-methylimidazol-2-yl)methoxy]benzaldehyde
InChI:
InChI=1S/C12H12N2O2/c1-14-7-6-13-12(14)9-16-11-4-2-10(8-15)3-5-11/h2-8H,9H2,1H3
InChI Key:
DMUKYFSMBNHCHM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCc1nccn1C

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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