Benzaldehyde | CAS No. 100-52-7

Benzaldehyde

Basic Information

CAS Number

100-52-7

Molecular Formula

C7H6O

Molecular Weight

106.12 g/mol

AD

Basic Physical Properties

Melting Point

−26 °C

Boiling Point

178-179 °C

Water Solubility

<0.01 g/100 mL at 19.5 ºC

Solubility

H2O: soluble100mg/mL

Refractive Index

n20/D 1.545(lit.)

Vapor Pressure

4 mmHg ( 45 °C)

Vapor Density

3.65 (NTP, 1992) (Relative to Air)

Odor

Characteristic odor or volatile oil of almond

c1ccc(cc1)C=O

InChI

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

InChIKey

HUMNYLRZRPPJDN-UHFFFAOYSA-N

LogP

1.4990999999999999

pKa

14.90(at 25℃)

Topological Polar Surface Area

17.07 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

72.5

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Hazard Class

Class 9 Class 9

Stability

Stable. Combustible. Incompatible with strong oxidizing agents, strong acids, reducing agents, steam. Air, light and moisture-sensitive.

Sensitiveness

Air Sensitive

Explosive Limit

1.4-8.5%(V)

Toxicity

LD50 in rats, guinea pigs (mg/kg): 1300, 1000 orally (Jenner)

Synonyms & References

English

  • Benzaldehyde
  • ARTIFICIAL ESSENTIAL OIL OF ALMOND
  • BALD
  • BENZENECARBONAL
  • BENZOIC ALDEHYDE
  • BENZYL ALDEHYDE
  • BITTER ALMOND OIL
  • FEMA 2127
  • OIL OF BITTER ALMOND
  • phenylmethanal
  • Almond artificial essential oil
  • Artifical essential oil of almond
  • Artificial Almond Oil
  • Artificial bitter almond oil
  • Benzaldehyde FFC
  • Benzaldehyde Solution
  • BENZALDEHYDE(AS)
  • Benaldehyde
  • Benzaldehyd
  • Benzaldehyde (List CheMical)
  • Benzaldehyde,redistilled,AcroSeal
  • Benzoylhydride
  • Benzyaldehyde
  • NA 1989
  • NCI-C56133
  • Benzenecarboxaldehyde
  • Benzenemethylal
  • Benzene carbaldehyde
  • Benzene carboxaldehyde
  • benzanoaldehyde
  • Benzylaldehyde

MDL Number

MFCD00003299

Customs Code

2912210000

FAQ

What are the physical and chemical properties of Benzaldehyde (CAS: 100-52-7)?

Benzaldehyde is a colorless liquid with a distinctive almond-like odor. Its molecular weight is approximately 106.12 g/mol. It has a melting point of -26°C and a boiling point of 178.2°C. Benzaldehyde is slightly soluble in water but miscible with ethanol and ether. It is highly reactive, particularly towards nucleophiles and reducing agents.

How is Benzaldehyde (CAS: 100-52-7) typically synthesized?

Benzaldehyde is commonly synthesized via the hydrolysis of toluene dioxide, a process known as Kolbe-Schmitt reaction. Another method involves the oxidation of toluene with a silver catalyst. These processes provide good yields and selectivity, making them suitable for industrial production.

What industries use Benzaldehyde (CAS: 100-52-7)?

Benzaldehyde is widely used in the food and flavor industry as a flavoring agent. It is also employed in the pharmaceutical industry for the synthesis of certain drugs. Additionally, it finds applications in the production of perfumes, dyes, and as a chemical intermediate in the manufacture of polymers and semiconductors.

What precautions should be taken when handling Benzaldehyde (CAS: 100-52-7)?

When handling benzaldehyde, appropriate personal protective equipment (PPE) should be worn, including gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood to minimize exposure. Spills should be cleaned up using appropriate absorbent materials, and the area should be well-ventilated. Always consult the Safety Data Sheet (SDS) for detailed handling and emergency procedures.

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