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Merck
CN

12015

Benzaldehyde

purum, ≥98.0% (GC)

Synonym(s):

Bitter almond

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About This Item

Linear Formula:
C6H5CHO
CAS Number:
Molecular Weight:
106.12
EC Number:
202-860-4
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
471223
MDL number:
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InChI key

HUMNYLRZRPPJDN-UHFFFAOYSA-N

InChI

1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H

SMILES string

O=Cc1ccccc1

vapor density

3.7 (vs air)

vapor pressure

4 mmHg ( 45 °C)

grade

purum

assay

≥98.0% (GC)

autoignition temp.

374 °F

expl. lim.

1.4 %, 20 °F

impurities

chlorine, none detected

bp

178-179 °C (lit.)

mp

−26 °C (lit.)

density

1.044 g/cm3 at 20 °C (lit.)

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Other Notes

Sales restrictions may apply

signalword

Danger

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 2 - Eye Irrit. 2 - Repr. 1B - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 1

flash_point_f

145.4 °F - closed cup

flash_point_c

63 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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An analytical model for the prediction of the local concentration of cryophylactic agents in perfused organs.
B Rubinsky et al.
Cryobiology, 16(4), 362-371 (1979-08-01)
Structure and electronic nature of the benzaldehyde/boron trifluoride adduct.
M T Reetz et al.
Journal of the American Chemical Society, 108(9), 2405-2408 (1986-04-01)
Porphyrinogens and porphodimethenes, intermediates in the synthesis of meso-tetraphenylporphins from pyrroles and benzaldehyde.
Dolphin D.
Journal of Heterocyclic Chemistry, 7, 275-283 (1970)
A green process for chlorine-free benzaldehyde from the solvent-free oxidation of benzyl alcohol with molecular oxygen over a supported nano-size gold catalyst.
Choudhary VR, et al.
Green Chemistry, 7(11), 768-770 (2005)
Determination of base properties of hydrotalcites: condensation of benzaldehyde with ethyl acetoacetate.
Corma A, et al.
J. Catal., 134(1), 58-65 (1992)

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