CAS 10364-94-0 | (1H-Imidazol-1-yl);(phenyl);methanone | CAS Number 10364-94-0

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10364-94-0 | (1H-Imidazol-1-yl);(phenyl);methanone

CAS No: 10364-94-0 Catalog No: AG003SQR MDL No:MFCD00014499

Product Description

Catalog Number:

AG003SQR

Chemical Name:

(1H-Imidazol-1-yl);(phenyl);methanone

CAS Number:

10364-94-0

Molecular Formula:

C10H8N2O

Molecular Weight:

172.1833

MDL Number:

MFCD00014499

IUPAC Name:

imidazol-1-yl(phenyl)methanone

InChI:

InChI=1S/C10H8N2O/c13-10(12-7-6-11-8-12)9-4-2-1-3-5-9/h1-8H

InChI Key:

JEGIFBGJZPYMJS-UHFFFAOYSA-N

SMILES:

O=C(n1cncc1)c1ccccc1

EC Number:

233-805-2

Properties

Complexity:

187

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.187g/mol

Monoisotopic Mass:

172.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3

Literature

Title	Journal
Synthesis, characterization, and in vitro evaluation of novel ruthenium(II) eta6-arene imidazole complexes.	Journal of medicinal chemistry 20060907
Cytotoxic activity of 5-benzoylimidazole and related compounds against human oral tumor cell lines.	Anticancer research 20010101