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402834

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
NACRES:
NA.21
PubChem Substance ID:
329755967
eCl@ss:
39023110
UNSPSC Code:
12352104
EC Number:
202-859-9
MDL number:
MFCD00004599
Beilstein/REAXYS Number:
878307
Assay:
≥99.0%
Grade:
ACS reagent
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 Segment

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

General description

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.
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.

Application

Benzyl alcohol may be used for the benzylation of toluene.

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pictograms

Exclamation mark
GHS07

signalword

Warning

Storage Class

10 - Combustible liquids

flash_point_f

213.8 °F - DIN 51758

flash_point_c

101 °C - DIN 51758

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Sens. 1B

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

Group 4: Flammable liquids + Type 3 petroleums + Hazardous rank III + Water insoluble liquid

fsl

Substances Subject to be Indicated Names

ishl_indicated

Substances Subject to be Notified Names

ishl_notified

402834-100ML:4.548173364094E12 + 402834-500ML:4.548173364261E12

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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)
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