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89015-12-3

89015-12-3 | Benzene,4-[[[1-(4-ethoxyphenyl)cyclopropyl]methoxy]methyl]-1-fluoro-2-phenoxy-

CAS No: 89015-12-3 Catalog No: AG0042UD MDL No:

Product Description

Catalog Number:
AG0042UD
Chemical Name:
Benzene,4-[[[1-(4-ethoxyphenyl)cyclopropyl]methoxy]methyl]-1-fluoro-2-phenoxy-
CAS Number:
89015-12-3
Molecular Formula:
C25H25FO3
Molecular Weight:
392.4626
IUPAC Name:
4-[[1-(4-ethoxyphenyl)cyclopropyl]methoxymethyl]-1-fluoro-2-phenoxybenzene
InChI:
InChI=1S/C25H25FO3/c1-2-28-21-11-9-20(10-12-21)25(14-15-25)18-27-17-19-8-13-23(26)24(16-19)29-22-6-4-3-5-7-22/h3-13,16H,2,14-15,17-18H2,1H3
InChI Key:
YVILZVWXXUNNKX-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)C1(COCc2ccc(c(c2)Oc2ccccc2)F)CC1

Properties

Complexity:
481  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.179g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
392.47g/mol
Monoisotopic Mass:
392.179g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8  

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