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Home > Imidazoles > 186096-23-1
186096-23-1 | 3-(1-Trityl-1H-imidazol-5-yl)propanal
CAS No: 186096-23-1 Catalog No: AG007SG9 MDL No:
Product Description
Catalog Number:
AG007SG9
Chemical Name:
3-(1-Trityl-1H-imidazol-5-yl)propanal
CAS Number:
186096-23-1
Molecular Formula:
C25H22N2O
Molecular Weight:
366.4550
IUPAC Name:
3-(3-tritylimidazol-4-yl)propanal
InChI:
InChI=1S/C25H22N2O/c28-18-10-17-24-19-26-20-27(24)25(21-11-4-1-5-12-21,22-13-6-2-7-14-22)23-15-8-3-9-16-23/h1-9,11-16,18-20H,10,17H2
InChI Key:
OADMTLRGVCYWJT-UHFFFAOYSA-N
SMILES:
O=CCCc1cncn1C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.173g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.464g/mol
Monoisotopic Mass:
366.173g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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