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1001505-70-9

1001505-70-9 | 3-[2-(1H-imidazol-1-yl)ethoxy]benzaldehyde

CAS No: 1001505-70-9 Catalog No: AG01A7Y5 MDL No:MFCD11171294

Product Description

Catalog Number:
AG01A7Y5
Chemical Name:
3-[2-(1H-imidazol-1-yl)ethoxy]benzaldehyde
CAS Number:
1001505-70-9
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD11171294
IUPAC Name:
3-(2-imidazol-1-ylethoxy)benzaldehyde
InChI:
InChI=1S/C12H12N2O2/c15-9-11-2-1-3-12(8-11)16-7-6-14-5-4-13-10-14/h1-5,8-10H,6-7H2
InChI Key:
BUWXMDPRTUPZIM-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCCn1cncc1

Properties

Complexity:
223  
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:
5  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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