CAS 6052-84-2 | Phenol,4,4'-(1,2-ethanediyl)bis- | CAS Number 6052-84-2

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6052-84-2 | Phenol,4,4'-(1,2-ethanediyl)bis-

CAS No: 6052-84-2 Catalog No: AG00370M MDL No:MFCD00785558

Product Description

Catalog Number:

AG00370M

Chemical Name:

Phenol,4,4'-(1,2-ethanediyl)bis-

CAS Number:

6052-84-2

Molecular Formula:

C14H14O2

Molecular Weight:

214.2598

MDL Number:

MFCD00785558

IUPAC Name:

4-[2-(4-hydroxyphenyl)ethyl]phenol

InChI:

InChI=1S/C14H14O2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10,15-16H,1-2H2

InChI Key:

URFNSYWAGGETFK-UHFFFAOYSA-N

SMILES:

Oc1ccc(cc1)CCc1ccc(cc1)O

UNII:

3OXU6S6XEX

NSC Number:

87365

Properties

Complexity:

167

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.264g/mol

Monoisotopic Mass:

214.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2

Literature

Title	Journal
Syntheses of lignin-derived thioacidolysis monomers and their uses as quantitation standards.	Journal of agricultural and food chemistry 20120201
Stilbene analogs as inducers of apolipoprotein-I transcription.	European journal of medicinal chemistry 20100501
Bibenzyl- and stilbene-core compounds with non-polar linker atom substituents as selective ligands for estrogen receptor beta.	European journal of medicinal chemistry 20090901
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	Journal of molecular graphics & modelling 20061101
Biodegradation of a variety of bisphenols under aerobic and anaerobic conditions.	Water science and technology : a journal of the International Association on Water Pollution Research 20060101