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99762-52-4

99762-52-4 | Morpholine, 4-(2-(4-(phenylmethyl)phenoxy)ethyl)-

CAS No: 99762-52-4 Catalog No: AG003W2H MDL No:

Product Description

Catalog Number:
AG003W2H
Chemical Name:
Morpholine, 4-(2-(4-(phenylmethyl)phenoxy)ethyl)-
CAS Number:
99762-52-4
Molecular Formula:
C19H23NO2
Molecular Weight:
297.3914
IUPAC Name:
4-[2-(4-benzylphenoxy)ethyl]morpholine
InChI:
InChI=1S/C19H23NO2/c1-2-4-17(5-3-1)16-18-6-8-19(9-7-18)22-15-12-20-10-13-21-14-11-20/h1-9H,10-16H2
InChI Key:
ZWLYTGBEZLXBKP-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)CCOc1ccc(cc1)Cc1ccccc1

Properties

Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.173g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.398g/mol
Monoisotopic Mass:
297.173g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Literature

Title Journal
Structure-activity relationship studies on 1-[2-(4-Phenylphenoxy)ethyl]pyrrolidine (SC-22716), a potent inhibitor of leukotriene A(4) (LTA(4)) hydrolase. Journal of medicinal chemistry 20000224

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