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188753-63-1 | Phenol, 4-[1-[4-(1-phenylethyl)phenyl]ethyl]-
CAS No: 188753-63-1 Catalog No: AG002H95 MDL No:
Product Description
Catalog Number:
AG002H95
Chemical Name:
Phenol, 4-[1-[4-(1-phenylethyl)phenyl]ethyl]-
CAS Number:
188753-63-1
Molecular Formula:
C22H22O
Molecular Weight:
302.4095
IUPAC Name:
4-[1-[4-(1-phenylethyl)phenyl]ethyl]phenol
InChI:
InChI=1S/C22H22O/c1-16(18-6-4-3-5-7-18)19-8-10-20(11-9-19)17(2)21-12-14-22(23)15-13-21/h3-17,23H,1-2H3
InChI Key:
IZIUEGNREMIBGB-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(c1ccc(cc1)C(c1ccccc1)C)C
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.167g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.417g/mol
Monoisotopic Mass:
302.167g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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