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Home > Aldehydes > 1340047-52-0
1340047-52-0 | 3-(1-ethyl-1H-imidazol-2-yl)benzaldehyde
CAS No: 1340047-52-0 Catalog No: AG01BHTD MDL No:MFCD19622008
Product Description
Catalog Number:
AG01BHTD
Chemical Name:
3-(1-ethyl-1H-imidazol-2-yl)benzaldehyde
CAS Number:
1340047-52-0
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
MDL Number:
MFCD19622008
IUPAC Name:
3-(1-ethylimidazol-2-yl)benzaldehyde
InChI:
InChI=1S/C12H12N2O/c1-2-14-7-6-13-12(14)11-5-3-4-10(8-11)9-15/h3-9H,2H2,1H3
InChI Key:
JFXGVJBSAMXGGY-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1nccn1CC
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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