4-(2-Methyl-2-propanyl)benzoic acid | CAS No. 98-73-7

4-(2-Methyl-2-propanyl)benzoic acid

Basic Information

CAS Number

98-73-7

Molecular Formula

C11H14O2

Molecular Weight

178.23 g/mol

AD

Basic Physical Properties

Melting Point

162-165 °C

Boiling Point

280°C

Density

0.6

Water Solubility

0.07 g/L (20 ºC)

Solubility

12.6g/l

Refractive Index

1.5201 (estimate)

CC(C)(C)c1ccc(cc1)C(=O)O

InChI

InChI=1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)

InChIKey

KDVYCTOWXSLNNI-UHFFFAOYSA-N

LogP

2.6823000000000006

pKa

4.38(at 25℃)

Topological Polar Surface Area

37.3 Ų

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

183

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302
H311H311
H332H332

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H311 Toxic in contact with skin
Acute toxicity, dermal
H332 Harmful if inhaled
Acute toxicity, inhalation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

  • 4-(tert-Butyl)benzoic acid
  • PTBBA
  • P-T-BUTYLBENZOIC ACID
  • P-TERT-BUTYLBENZOIC ACID
  • RARECHEM AL BO 0693
  • 4-(1,1-dimethylethyl)-benzoicaci
  • 4-(1,1-dimethylethyl)benzoicacid
  • 4-(1,1-dimethylethyl)-Benzoicacid
  • 4-tbba
  • 4-t-butylbenzoic acid
  • 4-tert-butyl-benzoicaci
  • acidetert-butyl-4benzoique
  • Benzoic acid, 4-(1,1-dimethylethyl)-
  • butylbenzoicacid
  • Kyselina p-terc.butylbenzoova
  • p-sec-Butylbenzoic acid
  • p-Secondary-butylbenzoic acid
  • 4-​tert-​Butylbenzoic Acid
  • 4-Tert.-Butylbenzoic Acid
  • 4-tert-Butylbenzoic acid
  • 4-t-Bu-benzoic acid
  • 4-tert-Bu-lbenzoic acid
  • 4-tert-butyl-benzoic acid
  • Benzoic acid,4-tert-butyl
  • Benzoic acid,p-tert-butyl
  • Methyl 4-tert-butylbenzoate
  • para-tert-butylbenzoic acid
  • TBBA
  • 对叔丁基苯甲酸
  • Benzoic acid, p-tert-butyl-
  • 4-tert-Butylbenzoicacid

MDL Number

MFCD00002563

Customs Code

29163900

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