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MilliporeSigma

402834

Sigma-Aldrich

Benzyl alcohol

ACS reagent, ≥99.0%

Synonym(s):

Benzenemethanol

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About This Item

Linear Formula:
C6H5CH2OH
CAS Number:
100-51-6
Molecular Weight:
108.14
Beilstein/REAXYS Number:
878307
EC Number:
202-859-9
MDL number:
MFCD00004599
UNSPSC Code:
12352104
eCl@ss:
39023110
PubChem Substance ID:
329755967
NACRES:
NA.21
Grade:
ACS reagent
Assay:
≥99.0%
Bp:
203-205 °C (lit.)
Vapor pressure:
13.3 mmHg ( 100 °C)
3.75 mmHg ( 77 °C)

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grade

ACS reagent

Quality Level

200

vapor density

3.7 (vs air)

vapor pressure

13.3 mmHg ( 100 °C)
3.75 mmHg ( 77 °C)

assay

≥99.0%

form

liquid

autoignition temp.

817 °F

expl. lim.

0.34-6.3 %

dilution

(for analytical testing)

impurities

≤0.01% Benzaldehyde (C6H5CHO)
≤0.02% Acetophenone (C6H5COCH3)

ign. residue

≤0.005%

color

APHA: ≤20

refractive index

n20/D 1.539 (lit.)

bp

203-205 °C (lit.)

mp

−16-−13 °C (lit.)

density

1.045 g/mL at 25 °C (lit.)

SMILES string

OCc1ccccc1

InChI

1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2

InChI key

WVDDGKGOMKODPV-UHFFFAOYSA-N

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General description

Benzyl alcohol (BnOH) is a monoaromatic primary alcohol widely used as a solvent and an intermediate in cosmetic formulations, pharmaceutical and flavor/fragrance industries. Commercial method for its synthesis is by the alkaline hydrolysis of benzyl chloride. Conformational studies by ab initio calculations shows gauche cis conformation around the alcoholic group.
Our premium ACS solvents are ideal for routine chemical synthesis, drying, purification, and critical labware cleaning. They meet or exceed the rigorous standards of the American Chemical Society (ACS), ensuring high-quality results for your research needs.

Premium ACS Solvents: Our solvents meet or exceed the stringent standards set by the American Chemical Society, ensuring high quality and reliability for your laboratory applications.

Replicable and Publishable Results: Designed for consistency, our solvents deliver results that can be reliably reproduced, making them ideal for research that requires publication.

Versatile Applications: Suitable for routine chemical synthesis, drying, purification, and critical labware cleaning, our solvents cater to a wide range of research needs in the laboratory.

Application

Benzyl alcohol may be used for the benzylation of toluene.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2

Storage Class

10 - Combustible liquids

wgk_germany

WGK 1

flash_point_f

213.8 °F - DIN 51758

flash_point_c

101 °C - DIN 51758

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Certificates of Analysis (COA)

Lot/Batch Number
SHBP3309
SHBM2850
SHBM0533
SHBL8964
SHBL8300

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Application of statistical design to benzylation of toluene with benzyl alcohol.
Alam A, et al.
Chemical Engineering & Technology, 31(3), 417-420 (2008)
Engineering Escherichia coli for renewable benzyl alcohol production.
Pugh S, et al.
Metabolic Engineering Communications, 2, 39-45 (2015)
The most stable conformer of benzyl alcohol.
Miller BJ, et al.
Chemical Physics Letters, 466(1), 21-26 (2008)
Poincyane Assis-Nascimento et al.
Journal of neuroscience methods, 263, 57-67 (2016-02-09)
Traumatic brain injury (TBI) continues to be a major source of death and disability worldwide, and one of the earliest and most profound deficits comes from vascular damage and breakdown of the blood-brain barrier (BBB). Cerebral vascular endothelial cells (cvECs)
Doyeon Kim et al.
Theranostics, 11(1), 79-92 (2021-01-05)
Transarterial chemoembolization (TACE) is an image-guided locoregional therapy used for the treatment of patients with primary or secondary liver cancer. However, conventional TACE formulations are rapidly dissociated due to the instability of the emulsion, resulting in insufficient local drug concentrations
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