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88934-59-2 | 1-({[1-(4-ethoxyphenyl)cyclopropyl]methoxy}methyl)-3-phenoxybenzene
CAS No: 88934-59-2 Catalog No: AG0048UH MDL No:
Product Description
Catalog Number:
AG0048UH
Chemical Name:
1-({[1-(4-ethoxyphenyl)cyclopropyl]methoxy}methyl)-3-phenoxybenzene
CAS Number:
88934-59-2
Molecular Formula:
C25H26O3
Molecular Weight:
374.4721
IUPAC Name:
1-ethoxy-4-[1-[(3-phenoxyphenyl)methoxymethyl]cyclopropyl]benzene
InChI:
InChI=1S/C25H26O3/c1-2-27-22-13-11-21(12-14-22)25(15-16-25)19-26-18-20-7-6-10-24(17-20)28-23-8-4-3-5-9-23/h3-14,17H,2,15-16,18-19H2,1H3
InChI Key:
YJAIEOAUIZKUAA-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)C1(COCc2cccc(c2)Oc2ccccc2)CC1
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.188g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.48g/mol
Monoisotopic Mass:
374.188g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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