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87005-19-4

87005-19-4 | Phenol, 2-(2-phenylcyclohexyl)-

CAS No: 87005-19-4 Catalog No: AG004KAP MDL No:

Product Description

Catalog Number:
AG004KAP
Chemical Name:
Phenol, 2-(2-phenylcyclohexyl)-
CAS Number:
87005-19-4
Molecular Formula:
C18H20O
Molecular Weight:
252.3508
IUPAC Name:
2-(2-phenylcyclohexyl)phenol
InChI:
InChI=1S/C18H20O/c19-18-13-7-6-12-17(18)16-11-5-4-10-15(16)14-8-2-1-3-9-14/h1-3,6-9,12-13,15-16,19H,4-5,10-11H2
InChI Key:
DYPPCHVAOLJBKX-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C1CCCCC1c1ccccc1

Properties

Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.151g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.357g/mol
Monoisotopic Mass:
252.151g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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