4-Formylbenzoic acid | CAS No. 619-66-9

4-Formylbenzoic acid

Basic Information

CAS Number

619-66-9

Molecular Formula

C8H6O3

Molecular Weight

150.13 g/mol

AD

Basic Physical Properties

Melting Point

247 °C

Boiling Point

332.6°C at 760 mmHg

Density

1.2645 (rough estimate)

Water Solubility

Soluble in water, methanol, DMSO, ether, and chloroform.

Flash Point

169.2℃

Refractive Index

1.4500 (estimate)

C1=CC(=CC=C1C=O)C(=O)O

InChI

InChI=1S/C8H6O3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H,(H,10,11)

InChIKey

GOUHYARYYWKXHS-UHFFFAOYSA-N

LogP

1.1973

pKa

3.77(at 25℃)

Topological Polar Surface Area

54.37 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

157

Safety Information

View Safety Information

GHS Hazard Pictograms

H315H315
H319H319
H335H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • 4-carboxybenzaldehyd
  • Terephthalaldehydic acid
  • DTXCID907249
  • CHEMBL113897
  • 4carboxybenzaldehyde
  • 4-Carboxybenzaladehyde
  • AKOS000119630
  • p-benzoic acid aldehyde
  • 4-CARBOXLYBENZALDEHYDE
  • 4-FormylbenzoicAcid
  • EINECS 210-607-4
  • EN300-19872
  • 4-Carboxybenzaldehyde treated BSA
  • SY001684
  • p-Carboxybenzaldehyde
  • BP-20406
  • NSC 15797
  • AE-562/40596592
  • 4-carboxy benzaldehyde
  • 4-10-00-02752 (Beilstein Handbook Reference)
  • Q23662583
  • para-carboxybenzaldehyde
  • Tox21_202478
  • Z104475878
  • Terephthaldehydic acid
  • D71017
  • NSC15797
  • TEREPHTHALALDEHYDE ACID
  • MFCD00006951
  • doi:10.14272/GOUHYARYYWKXHS-UHFFFAOYSA-N.1
  • CHEBI:191179

MDL Number

MFCD00006951

Customs Code

29183000

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