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436804-74-9 | 1H-Imidazole, 2-(2-phenylethynyl)-
CAS No: 436804-74-9 Catalog No: AG00DXA9 MDL No:
Product Description
Catalog Number:
AG00DXA9
Chemical Name:
1H-Imidazole, 2-(2-phenylethynyl)-
CAS Number:
436804-74-9
IUPAC Name:
2-(2-phenylethynyl)-1H-imidazole
InChI:
InChI=1S/C11H8N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-5,8-9H,(H,12,13)
InChI Key:
AWDSDPLABOQAFU-UHFFFAOYSA-N
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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