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Home > Pyridines > 113381-79-6
113381-79-6 | Phenol, 4,4'-[1-(4-pyridinyl)ethylidene]bis-
CAS No: 113381-79-6 Catalog No: AG0008D5 MDL No:
Product Description
Catalog Number:
AG0008D5
Chemical Name:
Phenol, 4,4'-[1-(4-pyridinyl)ethylidene]bis-
CAS Number:
113381-79-6
Molecular Formula:
C19H17NO2
Molecular Weight:
291.3438
IUPAC Name:
4-[1-(4-hydroxyphenyl)-1-pyridin-4-ylethyl]phenol
InChI:
InChI=1S/C19H17NO2/c1-19(16-10-12-20-13-11-16,14-2-6-17(21)7-3-14)15-4-8-18(22)9-5-15/h2-13,21-22H,1H3
InChI Key:
FGXMGGGZWVTYOS-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(c1ccc(cc1)O)(c1ccncc1)C
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.126g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.35g/mol
Monoisotopic Mass:
291.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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