p-Toluic acid | CAS No. 99-94-5

p-Toluic acid

Basic Information

CAS Number

99-94-5

Molecular Formula

C8H8O2

Molecular Weight

136.15 g/mol

AD

Basic Physical Properties

Melting Point

177-180 °C

Boiling Point

274-275 °C

Density

1.060

Water Solubility

<0.1 g/100 mL at 19 ºC

Flash Point

181℃

Solubility

0.3g/l

Refractive Index

1.5120 (estimate)

CC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C8H8O2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H,9,10)

InChIKey

LPNBBFKOUUSUDB-UHFFFAOYSA-N

LogP

1.69322

pKa

4.36(at 25℃)

Topological Polar Surface Area

37.3 Ų

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

123

Safety Information

View Safety Information

Hazard Statement

H303 May be harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H402 Harmful to aquatic life
Hazardous to the aquatic environment, acute hazard

Synonyms & References

English

  • p-methyl benzoic acid
  • rho-toluic acid
  • 4-Methyl-Benzoic Acid
  • DTXCID801618
  • p-Toluylic acid
  • DTXSID6021618
  • AI3-15627
  • C01454
  • P-TOLUIC ACID
  • CS-D0602
  • Toluate
  • p-toluic-2,3,5,6-d4 acid
  • 99-94-5
  • 4-Methyl benzoic acid
  • p-Methylbenzoic acid
  • P-TOLUIC ACID [MI]
  • W-100006
  • 4-MethylbenzoicAcid
  • para toluic acid
  • CAS-99-94-5
  • 4-Methylbenzoic acid(Flakes or Chunks or Granular)
  • BDBM197303
  • para-Toluic acid
  • 4-Methylbenzoic acid
  • p-Toluic acid, Vetec(TM) reagent grade, 98%
  • CHEMBL21708
  • 4-methylbenzenecarboxylic acid
  • NSC 2215
  • Q1607905
  • 4-Toluic acid
  • 2420-97-5 (cadmium salt)

MDL Number

MFCD00002565

Customs Code

29163900

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