ChemicalBook > CAS DataBase List > 4-TERT-BUTYLPHENYLACETIC ACID

4-TERT-BUTYLPHENYLACETIC ACID

Product Name
4-TERT-BUTYLPHENYLACETIC ACID
CAS No.
32857-63-9
Chemical Name
4-TERT-BUTYLPHENYLACETIC ACID
Synonyms
BTS-10335;ASISCHEM Y85510;RARECHEM AL BO 0709;Butylphenylessigsureca;4-T-BUTYLPHENYLACETIC ACID;Phenylacetic acid tert-butyl;2-(4-tert-butylphenyl)acetate;4-TERT-BUTYLPHENYLACETIC ACID;p-tert-Butylphenylacetic acid;4-Tert-Butylbenzeneacetic Acid
CBNumber
CB7409336
Molecular Formula
C12H16O2
Formula Weight
192.25
MOL File
32857-63-9.mol
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4-TERT-BUTYLPHENYLACETIC ACID Property

Melting point:
77-78°C
Boiling point:
302.8±11.0 °C(Predicted)
Density 
1.047±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
solubility 
soluble in Methanol
form 
powder to crystal
pka
4.41±0.10(Predicted)
color 
White to Almost white
InChI
InChI=1S/C12H16O2/c1-12(2,3)10-6-4-9(5-7-10)8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14)
InChIKey
RUAYXHSDAMWEDR-UHFFFAOYSA-N
SMILES
C1(CC(O)=O)=CC=C(C(C)(C)C)C=C1
CAS DataBase Reference
32857-63-9(CAS DataBase Reference)
EPA Substance Registry System
Benzeneacetic acid, 4-(1,1-dimethylethyl)- (32857-63-9)
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Safety

Hazard Codes 
Xi,Xn
Risk Statements 
36/37/38-22
Safety Statements 
26-36/37/39
HazardClass 
IRRITANT
HS Code 
29163990
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

Precautionary statements

P280Wear protective gloves/protective clothing/eye protection/face protection.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TCI Chemical
Product number
B4307
Product name
4-tert-Butylphenylacetic Acid
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$32
Updated
2025/07/31
TCI Chemical
Product number
B4307
Product name
4-tert-Butylphenylacetic Acid
Purity
>98.0%(GC)(T)
Packaging
25g
Price
$108
Updated
2025/07/31
TRC
Product number
B809655
Product name
4-tert-Butylphenylacetic Acid
Packaging
500mg
Price
$75
Updated
2021/12/16
Matrix Scientific
Product number
034848
Product name
4-tert-Butylphenylacetic acid
Purity
98%
Packaging
1g
Price
$10
Updated
2021/12/16
Apolloscientific
Product number
OR7658
Product name
4-tert-Butylphenylacetic Acid
Purity
97+%
Packaging
1g
Price
$24
Updated
2021/12/16
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4-TERT-BUTYLPHENYLACETIC ACID Chemical Properties,Usage,Production

Chemical Properties

Almost white crystalline powder

Synthesis

3549-23-3

32857-63-9

The general procedure for the synthesis of 4-tert-butylphenylacetic acid from methyl 4-tert-butylphenylacetate was as follows: 4-tert-butylphenylacetic acid methyl ester (4.13 g, 20 mmol) was dissolved in methanol (160 mL), and water (40 mL) and sodium hydroxide (1.2 g, 30 mmol) were added sequentially. The reaction mixture was stirred at room temperature overnight. Upon completion of the reaction, the volatile solvent was removed by distillation under reduced pressure, and the residue was diluted with water and acidified with 1 N sulfuric acid solution to pH 4. The precipitated solid was filtered, washed with water, and dried to afford 4-tert-butylphenylacetic acid as a white solid in 39% yield. The structure of the product was confirmed by 1H NMR (400 MHz, CDCl3) and 13C NMR (101 MHz, CDCl3): 1H NMR δ 1.32 (s, 9H), 3.60 (s, 2H), 7.22 (d, J = 8.2 Hz, 2H), 7.35 (d, J = 8.2 Hz, 2H), 8.48 (s, 1H) ppm; 13C NMR δ 31.49 (3C), 34.62, 40.84, 125.70 (2C), 129.16 (2C), 130.57, 150.29, 177.92 ppm.

References

[1] Tetrahedron Asymmetry, 2016, vol. 27, # 19, p. 936 - 942
[2] Bioorganic and Medicinal Chemistry Letters, 2004, vol. 14, # 9, p. 2047 - 2050
[3] Journal of Medicinal Chemistry, 2000, vol. 43, # 23, p. 4354 - 4358
[4] Patent: WO2004/69792, 2004, A2. Location in patent: Page 125
[5] Bioorganic and Medicinal Chemistry Letters, 2009, vol. 19, # 9, p. 2386 - 2391

4-TERT-BUTYLPHENYLACETIC ACID Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 4-TERT-BUTYLPHENYLACETIC ACID manufacturers

Shaanxi Dideu Medichem Co. Ltd
Product
4-TERT-BUTYLPHENYLACETIC ACID 32857-63-9
Price
US $1.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
20T
Release date
2024-08-13
Career Henan Chemical Co
Product
4-TERT-BUTYLPHENYLACETIC ACID 32857-63-9
Price
US $1.00/kg
Min. Order
1kg
Purity
95%-99%
Supply Ability
100kg
Release date
2018-12-20

32857-63-9, 4-TERT-BUTYLPHENYLACETIC ACIDRelated Search:

METHYL 4-TERT-BUTYLPHENYLACETATE, 97 4-tert-Butylbenzyl bromide 4'-tert-Butyl-4-chlorobutyrophenone 4-tert-Butylbenzyl chloride 4-TERT-BUTYLPHENYLACETIC ACID METHYL ESTER 4-TERT-BUTYLPHENYLACETIC ACID tert-Butylbenzene BTS ETHYL 4-TERT-BUTYLBENZOYLFORMATE AMINO(4-TERT-BUTYLPHENYL)ACETIC ACID 4-TERT-BUTYLCALIX(8)ARENE-OCTAACETIC ACID 2-(4-TERT-BUTYLPHENYL)-3,3,3-TRIFLUORO-2-HYDROXYPROPIONIC ACID (S)-2-HYDROXY-2-METHYL(4-TERT-BUTYLBENZENE)ACETIC ACID (R)-(4-TERT-BUTYL-PHENYL)-[(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)]-ACETIC ACID (S)-AMINO-(4-TERT-BUTYL-PHENYL)-ACETIC ACID (2R)-2-AMINO-2-[4-(TERT-BUTYL)PHENYL]PROPANOIC ACID (R)-2-HYDROXY-2-METHYL(4-TERT-BUTYLBENZENE)ACETIC ACID (S)-(4-TERT-BUTYL-PHENYL)-[(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)]-ACETIC ACID

  • 4-(1,1-dimethylethyl)-benzeneaceticaci
  • RARECHEM AL BO 0709
  • 4-T-BUTYLPHENYLACETIC ACID
  • 4-TERT-BUTYLPHENYLACETIC ACID
  • BENZENEACETIC ACID, 4-(1,1-DIMETHYLETHYL)-
  • ASISCHEM Y85510
  • 2-(4-tert-butylphenyl)acetate
  • 4-Tert-Butylbenzeneacetic Acid
  • Butylphenylessigsureca
  • 4-(t-Butyl)-phenylacetic acid , ca. 98%
  • ButylphenylaceticacidButylphenylaceticacid
  • 4-tert-Butylphenylacetic acid 98%
  • BTS-10335
  • p-tert-Butylphenylacetic acid
  • 4-tert-Butylphenylacetic acid,97%
  • Phenylacetic acid tert-butyl
  • 4-<i>tert</i>-Butylphenylacetic Acid
  • 4-tert-Butylphenylacetic Acid &gt
  • 2-(4-tert-butylphenyl)aceticaci
  • 4-(1,1-Dimethylethyl)benzeneacetic acid
  • 32857-63-9
  • CARBOXYLIC ACID
  • Aromatic Phenylacetic Acids and Derivatives
  • pharmacetical