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3-tert-Butylphenol

3-tert-Butylphenol Structure
3-tert-Butylphenol structure
CAS No.
585-34-2
Chemical Name:
3-tert-Butylphenol
Synonyms
Phenol, m-tert-butyl-;3-t-Butylphenol;M-TERT-BUTYLPHENOL;3-tert.-Butylp;M-T-BUTYLPHENOL;3-(1, 98.0%(GC);3-TERT-BUTYLPHENOL;3-TENT-BUTYLPHEHOL;Phenol, 3-tert-butyl-;3-tert-Butylphenol,99%
CBNumber:
CB1323713
Molecular Formula:
C10H14O
Molecular Weight:
150.22
MDL Number:
MFCD00002300
MOL File:
585-34-2.mol
MSDS File:
SDS
Last updated:2026-06-04 16:00:12
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3-tert-Butylphenol Properties

Melting point 44-46 °C (lit.)
Boiling point 125-130 °C/20 mmHg (lit.)
Density 0.9688 (estimate)
refractive index 1.5108 (estimate)
Flash point 228 °F
storage temp. Inert atmosphere,Room Temperature
Water Solubility Practically insoluble in water
solubility Chloroform (Slightly), Methanol (Slightly)
form Crystalline Powder
pka 10.12(at 25℃)
color White to almost white
Henry's Law Constant 5.1×100 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
InChI 1S/C10H14O/c1-10(2,3)8-5-4-6-9(11)7-8/h4-7,11H,1-3H3
InChIKey CYEKUDPFXBLGHH-UHFFFAOYSA-N
SMILES CC(C)(C)c1cccc(O)c1
LogP 3.300
CAS DataBase Reference 585-34-2(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 2382U55WN2
NIST Chemistry Reference Phenol, m-tert-butyl-(585-34-2)
EPA Substance Registry System m-tert-Butylphenol (585-34-2)
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  Corrosion (GHS05)
GHS05
Signal word  Danger
Hazard statements  H314
Precautionary statements  P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
PPE Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
Hazard Codes  C
Risk Statements  34-20/21/22
Safety Statements  26-27-28-36/37/39-45
RIDADR  UN 2430 8/PG 3
WGK Germany  3
TSCA  TSCA listed
HazardClass  8
PackingGroup  III
HS Code  29071990
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Eye Dam. 1
Skin Corr. 1B
Limited Quantities 5.0 kg (11 lbs) (solid)
Excepted Quantities Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
NFPA 704
1
3 0

3-tert-Butylphenol price More Price(48)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 124281 3-tert-Butylphenol 99% 585-34-2 1g $42.3 2026-04-30 Buy
TCI Chemical B0731 3-tert-Butylphenol >98.0%(GC) 585-34-2 25g $73 2026-04-30 Buy
TCI Chemical B0731 3-tert-Butylphenol >98.0%(GC) 585-34-2 500g $451 2026-04-30 Buy
AK Scientific L563 3-tert-Butylphenol 98%(GC) 585-34-2 5g $16 2026-06-04 Buy
AK Scientific L563 3-tert-Butylphenol 98%(GC) 585-34-2 25g $25 2026-06-04 Buy
Product number Packaging Price Buy
124281 1g $42.3 Buy
B0731 25g $73 Buy
B0731 500g $451 Buy
L563 5g $16 Buy
L563 25g $25 Buy

3-tert-Butylphenol Chemical Properties,Uses,Production

Synthesis

Methyl trifluoromethanesulfonate (0.88 mmol) was added to a solution of 2-(3-(pentane-3-yl)phenoxy)pyridine in dry toluene, and the solution was stirred at 100°C for 2 hours under N2 atmosphere. The reaction mixture was cooled to ambient temperature, the solvent was evaporated under vacuum, the crude product was dissolved in dry methanol, and a solution of metallic sodium (12 mmol) in dry methanol was added under N2 atmosphere. The reaction mixture was heated to reflux for 15 minutes, and then cooled to room temperature. After the reaction was complete, the solvent was evaporated under vacuum and water (70 mL) was added. The reaction mixture was extracted with ethyl acetate (50 mL × 3), the combined organic layers were dried on anhydrous Na2SO4, the solution was concentrated under vacuum, and the residue was purified by silica gel column chromatography (PE/EtOAc 6:1 as eluent) to give 3-tert-butylphenol.

Synthetic Route of 3-tert-Butylphenol

Figure 3. Synthetic Route of 3-tert-Butylphenol

Chemical Properties

WHITE TO ALMOST WHITE CRYSTALLINE POWDER

Uses

3-tert-Butylphenol has been used to study the effect of alkyl group on the phenol ring on the estrogenic potency of alkylphenolic compounds in the yeast screen.

Definition

ChEBI: 3-tert-Butylphenol is an alkylbenzene.

Synthesis Reference(s)

Journal of the American Chemical Society, 83, p. 2507, 1961 DOI: 10.1021/ja01472a021

General Description

3-tert-Butylphenol undergoes stereoselective hydrogenation over charcoal-supported rhodium catalyst in supercritical carbon dioxide solvent.

3-tert-Butylphenol synthesis

507-20-0
108-95-2
98-54-4
585-34-2
Synthesis of 3-tert-Butylphenol from 2-Chloro-2-methylpropane and Phenol

3-tert-Butylphenol Preparation Products And Raw materials

Raw materials

Preparation Products

Anoxomer 3-tert-butylbromobenzene Methanesulfonic acid, 1,1,1-trifluoro-, 3-(1,1-dimethylethyl)phenyl ester Benzonitrile, 4-(1,1-dimethylethyl)-2-ethoxy- (9CI) m-tert-butylphenyl methylcarbamate
[3-(1,1-dimethylethyl)phenoxy]acetic acid 4-TERT-BUTYL-2-ETHOXY-BENZOIC ACID METHYL ESTER

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3-tert-Butylphenol Suppliers

Global( 264)Suppliers
Supplier Tel Email Country ProdList Advantage
Weiyuan Biotechnology (Pingdingshan) Co., Ltd. 13703782753 18738962810 xfx@iwysw.com China 66 62
J & K SCIENTIFIC LTD. 18210857532 18210857532 jkinfo@jkchemical.com China 96815 76
Meryer (Shanghai) Chemical Technology Co., Ltd. 4006356688 18621169109 market03@meryer.com China 40202 62
3B Pharmachem (Wuhan) International Co.,Ltd. 18930552037 3bsc@sina.com China 15813 69
future industrial shanghai co., ltd 400-0066400 13621662912 sales@jonln.com China 1989 65
Alfa Aesar 400-6106006 saleschina@alfa-asia.com China 30103 84
TCI (Shanghai) Development Co., Ltd. 021-67121386 Sales-CN@TCIchemicals.com China 24512 81
Beijing HwrkChemical Technology Co., Ltd 89508211 18501085097 sales.bj@hwrkchemical.com China 9407 55
Energy Chemical 400-0056266 sales8178@energy-chemical.com China 44850 61
Beijing Ouhe Technology Co., Ltd 13552068683 13522913783 2355560935@qq.com China 11777 60
Supplier Advantage
Weiyuan Biotechnology (Pingdingshan) Co., Ltd. 62
J & K SCIENTIFIC LTD. 76
Meryer (Shanghai) Chemical Technology Co., Ltd. 62
3B Pharmachem (Wuhan) International Co.,Ltd. 69
future industrial shanghai co., ltd 65
Alfa Aesar 84
TCI (Shanghai) Development Co., Ltd. 81
Beijing HwrkChemical Technology Co., Ltd 55
Energy Chemical 61
Beijing Ouhe Technology Co., Ltd 60

View Lastest Price from 3-tert-Butylphenol manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
3-tert-Butylphenol pictures 2026-09-02 3-tert-Butylphenol
585-34-2
 $10.00 1KG 99% Henan Fengda Chemical Co., Ltd
3-tert-Butylphenol pictures 2026-05-28 3-tert-Butylphenol
585-34-2
 $2.00-5.00 1KG 99% 10000kg Hebei Chuanghai Biotechnology Co,.LTD
3-tert-Butylphenol pictures 2026-03-20 3-tert-Butylphenol
585-34-2
 1KG 99% 20 mt Hebei Chuanghai Biotechnology Co., Ltd

3-tert-Butylphenol Spectrum

3-tert-Butylphenol(585-34-2)MS3-tert-Butylphenol(585-34-2)1HNMR3-tert-Butylphenol(585-34-2)13CNMR3-tert-Butylphenol(585-34-2)IR13-tert-Butylphenol(585-34-2)Raman

585-34-2(3-tert-Butylphenol)Related Search:

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THEBAINE tert-Butylhydroquinone 3,5-DI-TERT-BUTYLPHENOL

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3-TERT-BUTYLPHENOL 3-(1,1-dimethylethyl)-pheno 3-(1,1-dimethylethyl)-Phenol Phenol, 3-tert-butyl- PHENOL, 3-(1,1-DIMETHYLETHYL)- M-T-BUTYLPHENOL M-TERT-BUTYLPHENOL 3-tert-Butylphenol,99% 3-TERT-BUTYLPHENOL 98+% 3-TERT-BUTYL-PHENYLAMINE 5-tert-Butyl-1-hydroxybenzene Between thetert butylphenol 3-(1, 98.0%(GC) 3-tert-Butylphenol, 98.0%(GC) 3-tert.-Butylp 3-tert-Butylphenol 99% 3-TENT-BUTYLPHEHOL 3-tert-Butylphenol > 3-tert-Butylphenol 3-t-Butylphenol Phenol, m-tert-butyl- 585-34-2 Building Blocks Phenols Oxygen Compounds Organic Building Blocks Organic Building Blocks Oxygen Compounds Phenols Industrial/Fine Chemicals