Bis(2-hydroxyphenyl)methane

Product Information

Molecular Formula:
C13H12O2
Molecular Weight:
200.23
Description
Bis(2-hydroxyphenyl)methane (CAS# 2467-02-9) is a dihydroxydiphenyl methane and the ortho analogue of Bisphenol F (B519555). 2,2'-Bis(hydroxyphenyl)methane is a contact sensitizer found in resins and products based on phenol-formaldehyde.
Synonyms
2-[(2-hydroxyphenyl)methyl]phenol
IUPAC Name
2-[(2-hydroxyphenyl)methyl]phenol
Canonical SMILES
C1=CC=C(C(=C1)CC2=CC=CC=C2O)O
InChI
InChI=1S/C13H12O2/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15/h1-8,14-15H,9H2
InChI Key
MQCPOLNSJCWPGT-UHFFFAOYSA-N
Boiling Point
363-365 °C (Press: 758 Torr)
Melting Point
113-118 °C (lit.)
Purity
> 99.0 % (GC)
Density
1.208±0.06 g/cm3(Predicted)
Appearance
White to light yellow powder to crystal
LogP
2.68860

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P271, P272, P273, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501
Signal Word
Danger

Computed Properties

XLogP3
3.1
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
200.083729621 g/mol
Monoisotopic Mass
200.083729621 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
173
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-113817307-A Low-temperature low-smoke halogen-free flame-retardant PC material composition and preparation method thereof 2021-11-11
CN-113248717-A Polyimide film with high thermal stability and production process thereof 2021-06-11
CN-113101952-A Bi4O5I2/Bi5O7I composite photocatalyst and preparation method and application thereof 2021-04-02
CN-112940250-A Resin, photosensitive resin composition, and photosensitive resin film 2021-02-02
CN-112859517-A Photosensitive resin composition and application thereof 2020-12-25
CN-112569936-A Novel metal-doped catalyst for selectively synthesizing bisphenol F, and preparation method and application thereof 2020-12-14
CN-112358381-A Method for separating 2, 2' -bisphenol F from bisphenol F isomer mixture 2020-11-09
CN-112175182-A Positive photosensitive polyesteramide resin and composition using same 2020-09-30
WO-2022054897-A1 Curing agent composition for epoxy resins, epoxy resin composition, and coating material 2020-09-14
WO-2022050135-A1 Cured product production method, laminate production method, and semiconductor device production method 2020-09-07

Literatures

PMID Publication Date Title Journal
33049310 2021-04-01 Evaluation of a multiplexed, multispecies nuclear receptor assay for chemical hazard assessment Toxicology in vitro : an international journal published in association with BIBRA
22199670 2011-12-01 Redetermination of 2,4'-methyl-ene-diphenol Acta crystallographica. Section E, Structure reports online
19348452 2009-04-30 Conformational effects on excitonic interactions in a prototypical H-bonded bichromophore: bis(2-hydroxyphenyl)methane The journal of physical chemistry. A
19348453 2009-04-30 Conformational isomerization and collisional cooling dynamics of bis(2-hydroxyphenyl)methane The journal of physical chemistry. A
19097894 2009-02-01 Synthesis and antimicrobial activities of halogenated bis(hydroxyphenyl)methanes Bioorganic & medicinal chemistry letters
16497524 2006-11-01 Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods Journal of molecular graphics & modelling
15726146 2005-03-07 Dinuclear complexes of a pseudocalixarene macrocycle: structural consequences of intramolecular hydrogen bonding Dalton transactions (Cambridge, England : 2003)
15528811 2004-11-01 [2,6-Bis[(dimethylamino)methyl]pyridine-kappa3N](2,2-methylenediphenolato-kappa2O,O')dioxouranium(VI) acetone solvate Acta crystallographica. Section C, Crystal structure communications
14736233 2004-01-29 Inhibition of the bacterial enoyl reductase FabI by triclosan: a structure-reactivity analysis of FabI inhibition by triclosan analogues Journal of medicinal chemistry
11258977 2001-03-01 Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens Chemical research in toxicology
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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