2-[2,4-Bis(benzyloxy)phenyl]acetic Acid - CAS 66056-40-4

Catalog:	BB032894
Product Name:	2-[2,4-Bis(benzyloxy)phenyl]acetic Acid
CAS:	66056-40-4
Synonyms:	2-[2,4-bis(phenylmethoxy)phenyl]acetic acid; 2-[2,4-bis(phenylmethoxy)phenyl]acetic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	2-[2,4-bis(phenylmethoxy)phenyl]acetic acid
Description:	2-[2,4-Bis(benzyloxy)phenyl]acetic Acid (CAS# 66056-40-4 ) is a useful research chemical.
Molecular Weight:	348.39
Molecular Formula:	C22H20O4
Canonical SMILES:	C1=CC=C(C=C1)COC2=CC(=C(C=C2)CC(=O)O)OCC3=CC=CC=C3
InChI:	InChI=1S/C22H20O4/c23-22(24)13-19-11-12-20(25-15-17-7-3-1-4-8-17)14-21(19)26-16-18-9-5-2-6-10-18/h1-12,14H,13,15-16H2,(H,23,24)
InChI Key:	MJIBFVVTWAHLOE-UHFFFAOYSA-N
LogP:	4.47170

Publication Number	Title	Priority Date
CA-2666350-A1	Isolated hydroxy and n-oxide metabolites and derivatives of o-desmethylvenlafaxine and methods of treatment	20061025
EP-2086922-A2	Isolated hydroxy and n-oxide metabolites and derivatives of o-desmethylvenlafaxine and methods of treatment	20061025
JP-2010507667-A	Isolated hydroxy and N-oxide metabolites and derivatives of O-desmethylvenlafaxine and methods of treatment	20061025
US-2008261895-A1	Isolated hydroxy and n-oxide metabolites and derivatives of O-desmethylvenlafaxine and methods of treatment	20061025
WO-2008051558-A2	Isolated hydroxy and n-oxide metabolites and derivatives of o-desmethylvenlafaxine and methods of treatment	20061025

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Related Functional Groups

Carbonyl Compounds

[51493-02-8]
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[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1016519-61-1]
2-(Methyl-2-pyridylamino)acetic Acid

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Complexity:	412
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	348.13615911
Formal Charge:	0
Heavy Atom Count:	26
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	348.13615911
Rotatable Bond Count:	8
Topological Polar Surface Area:	55.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5