CAS 10041-02-8 | Phenol, 4-(1H-imidazol-1-yl)- | CAS Number 10041-02-8

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10041-02-8 | Phenol, 4-(1H-imidazol-1-yl)-

CAS No: 10041-02-8 Catalog No: AG0001XM MDL No:MFCD00005281

Product Description

Catalog Number:

AG0001XM

Chemical Name:

Phenol, 4-(1H-imidazol-1-yl)-

CAS Number:

10041-02-8

Molecular Formula:

C9H8N2O

Molecular Weight:

160.1726

MDL Number:

MFCD00005281

IUPAC Name:

4-imidazol-1-ylphenol

InChI:

InChI=1S/C9H8N2O/c12-9-3-1-8(2-4-9)11-6-5-10-7-11/h1-7,12H

InChI Key:

CYKCUAPYWQDIKR-UHFFFAOYSA-N

SMILES:

Oc1ccc(cc1)n1cncc1

EC Number:

233-121-4

Properties

Complexity:

144

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

160.064g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

160.176g/mol

Monoisotopic Mass:

160.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3

Literature

Title	Journal
Improved performance of antigen-HRP conjugate-based immunoassays after the addition of anti-HRP antibody and application of a liposomal chemiluminescence marker.	Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20120101
Bis(cyanamide-κN)[4-(1H-imidazol-1-yl)phenol-κN]bis-(nitrato-κO)copper(II).	Acta crystallographica. Section E, Structure reports online 20110901
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Electronic structure and (1)H NMR chemical shifts in host-guest complexes of cucurbit[6]uril and sym-tetramethyl cucurbit[6]uril with imidazole derivatives.	The journal of physical chemistry. A 20101014
Photophysical behaviour of 4-(imidazole-1-yl) phenol and its complexation with beta-cyclodextrin in ground and excited states.	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040801