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2,6-Bis(hydroxymethyl)-p-cresol

2,6-Bis(hydroxymethyl)-p-cresol

Name: 2,6-Bis(hydroxymethyl)-p-cresol
Brand: BOC Sciences
Price: 399 USD
Availability: MadeToOrder

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Molecular Formula:

C9H12O3

Molecular Weight:

168.19

CAS Number:

91-04-3

Catalog Number:

B1370-331577

Catalog Number	Size	Price	Stock	Quantity
B1370-331577	1 kg	$399	In stock

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Product Information

Molecular Formula:

C9H12O3

Molecular Weight:

168.19

Description

2,6-Bis(hydroxymethyl)-p-cresol is a useful research chemical.

Synonyms

2,6-Dimethylol-p-cresol; (2-Hydroxy-5-methyl-1,3-phenylene)dimethanol

IUPAC Name

2,6-bis(hydroxymethyl)-4-methylphenol

Canonical SMILES

CC1=CC(=C(C(=C1)CO)O)CO

InChI

InChI=1S/C9H12O3/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-3,10-12H,4-5H2,1H3

InChI Key

KUMMBDBTERQYCG-UHFFFAOYSA-N

Boiling Point

333.3 °C at 760 mmHg

Melting Point

126 °C

Purity

> 98.0 % (GC)

Density

1.276 g/cm³

Appearance

White to yellow to orange powder to crystal

LogP

0.68520

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501

Signal Word

Warning

Computed Properties

XLogP3

0.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

168.078644241 g/mol

Monoisotopic Mass

168.078644241 g/mol

Topological Polar Surface Area

60.7Å²

Heavy Atom Count

Formal Charge

Complexity

124

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Volume _(start)

Concentration _(final)

Volume _(final)

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2,6-Bis(hydroxymethyl)-p-cresol

Product Information

Safety Information

Computed Properties

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