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ChemicalBook >> CAS DataBase List >>3-TERT-BUTYL-4-HYDROXYBENZONITRILE

3-TERT-BUTYL-4-HYDROXYBENZONITRILE

CAS No.
4910-04-7
Chemical Name:
3-TERT-BUTYL-4-HYDROXYBENZONITRILE
Synonyms
2-tert-Butyl-4-cyanophenol;3-TERT-BUTYL-4-HYDROXYBENZONITRILE;3-(1,1-Dimethylethyl)-4-hydroxybenzonitrile;Benzonitrile, 3-(1,1-dimethylethyl)-4-hydroxy-
CBNumber:
CB12603345
Molecular Formula:
C11H13NO
Molecular Weight:
175.23
MDL Number:
MFCD16999179
MOL File:
4910-04-7.mol
MSDS File:
SDS
Last updated:2026-05-27 23:23:46
Product description Number Pack Size Price
3-(tert-Butyl)-4-hydroxybenzonitrile 97% OR917655 250mg $39
3-(tert-Butyl)-4-hydroxybenzonitrile 97% OR917655 1g $48
3-(tert-Butyl)-4-hydroxybenzonitrile 97% OR917655 5g $230
3-(tert-Butyl)-4-hydroxybenzonitrile 97% OR917655 250mg $39
3-(tert-Butyl)-4-hydroxybenzonitrile 97% OR917655 1g $48
More product size

3-TERT-BUTYL-4-HYDROXYBENZONITRILE Properties

Boiling point 293.5±28.0 °C(Predicted)
Density 1.07±0.1 g/cm3(Predicted)
storage temp. 2-8°C
pka 9.21±0.18(Predicted)
Appearance Light brown to brown Solid

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335-H412
Precautionary statements  P261-P273-P305+P351+P338
HS Code  2926907090

3-TERT-BUTYL-4-HYDROXYBENZONITRILE price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Apolloscientific OR917655 3-(tert-Butyl)-4-hydroxybenzonitrile 97% 4910-04-7 250mg $39 2026-06-04 Buy
Apolloscientific OR917655 3-(tert-Butyl)-4-hydroxybenzonitrile 97% 4910-04-7 1g $48 2026-06-04 Buy
Apolloscientific OR917655 3-(tert-Butyl)-4-hydroxybenzonitrile 97% 4910-04-7 5g $230 2026-06-04 Buy
Apolloscientific OR917655 3-(tert-Butyl)-4-hydroxybenzonitrile 97% 4910-04-7 250mg $39 2026-06-04 Buy
Apolloscientific OR917655 3-(tert-Butyl)-4-hydroxybenzonitrile 97% 4910-04-7 1g $48 2026-06-04 Buy
Product number Packaging Price Buy
OR917655 250mg $39 Buy
OR917655 1g $48 Buy
OR917655 5g $230 Buy
OR917655 250mg $39 Buy
OR917655 1g $48 Buy

3-TERT-BUTYL-4-HYDROXYBENZONITRILE Chemical Properties,Uses,Production

Synthesis

3-(tert-butyl)-4-hydroxybenzaldehyde

65678-11-7

3-TERT-BUTYL-4-HYDROXYBENZONITRILE

4910-04-7

The general procedure for the synthesis of 3-(tert-butyl)-4-hydroxybenzonitrile from 3-(tert-butyl)-4-hydroxybenzaldehyde is as follows: with reference to the synthesis of intermediate R10 3-(1,1-dimethylethyl)-4-hydroxybenzenecarbonitrile [1399], 3-(1,1-dimethylethyl)-4-hydroxybenzaldehyde (550 mg with reference to intermediate R9) was mixed with hydroxylamine hydrochloride (322 mg , 4.63 mmol) in 8.0 mL of acetic acid under reflux conditions for 1 hour. Upon completion of the reaction, the mixture was cooled to 0 °C and subsequently poured into ether (Et2O). The mixture was washed sequentially with water and 5% aqueous sodium hydroxide solution each. The aqueous phase was extracted twice with ether (Et2O), all organic phases were combined, dried with anhydrous sodium sulfate (Na2SO4), filtered and the solvent evaporated. The residue was ground with pentane to give 540 mg of 3-tert-butyl-4-hydroxybenzonitrile. The product was characterized by 1H-NMR (400 MHz, DMSO-d6): δ 10.92 (1H, broad single peak), 7.53-7.45 (2H, multiple peaks), 6.92 (1H, double peaks), 1.34 (9H, single peak); UPLC_ipqc analysis: retention time 1.03 min, mass spectrometry detected [M-H]-peak m/z 174.

References

[1] Patent: WO2011/69951, 2011, A1. Location in patent: Page/Page column 82-83
[2] Patent: WO2012/76877, 2012, A1. Location in patent: Page/Page column 226-227
[3] Patent: US2013/267510, 2013, A1. Location in patent: Paragraph 1399-1401

3-TERT-BUTYL-4-HYDROXYBENZONITRILE Preparation Products And Raw materials

Raw materials

Preparation Products

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ATK CHEMICAL COMPANY LIMITED
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Shanghai PharmOrgsyn Technology Co., LTD. 021-+86-021-38228826 13916602830; sales@pharmorgsyn.cn China 232 58
Credit Asia Chemical Co., Ltd. +86 (21) 61124340 China 9756 58
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3-TERT-BUTYL-4-HYDROXYBENZONITRILE Spectrum

3-TERT-BUTYL-4-HYDROXYBENZONITRILE 2-tert-Butyl-4-cyanophenol Benzonitrile, 3-(1,1-dimethylethyl)-4-hydroxy- 3-(1,1-Dimethylethyl)-4-hydroxybenzonitrile 4910-04-7
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