Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl

Modify Date: 2025-08-25 16:58:43

Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl Structure
Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl structure
Common Name Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl
CAS Number 879-97-0 Molecular Weight 178.27100
Density 0.952g/cm3 Boiling Point 248ºC at 760 mmHg
Molecular Formula C12H18O Melting Point N/A
MSDS N/A Flash Point 114.7ºC

 Names

Name 4-tert-butyl-2,6-dimethylphenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.952g/cm3
Boiling Point 248ºC at 760 mmHg
Molecular Formula C12H18O
Molecular Weight 178.27100
Flash Point 114.7ºC
Exact Mass 178.13600
PSA 20.23000
LogP 3.30650
Index of Refraction 1.512
InChIKey MEPYMUOZRROULQ-UHFFFAOYSA-N
SMILES Cc1cc(C(C)(C)C)cc(C)c1O

 Safety Information

HS Code 2907199090

 Synthetic Route

~83%

Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl Structure

Phenol,4-(1,1-d...

CAS#:879-97-0

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Literature: Kamitori, Yasuhiro; Hojo, Masaru; Masuda, Ryoichi; Izumi, Tatsuo; Tsukamoto, Shuichi Journal of Organic Chemistry, 1984 , vol. 49, # 22 p. 4161 - 4165

~%

Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl Structure

Phenol,4-(1,1-d...

CAS#:879-97-0

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Literature: Hultzsch Chemische Berichte, 1941 , vol. 74, p. 1533,1537

~%

Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl Structure

Phenol,4-(1,1-d...

CAS#:879-97-0

Learn More
Literature: Stevens Industrial and Engineering Chemistry, 1943 , vol. 35, p. 655,656

~%

Phenol,4-(1,1-dimethylethyl)-2,6-dimethyl Structure

Phenol,4-(1,1-d...

CAS#:879-97-0

Learn More
Literature: Tchitchibabine Bulletin de la Societe Chimique de France, 1932 , vol. <4> 51, p. 1436,1441

 Customs

HS Code 2907199090
Summary 2907199090 other monophenols VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

 Bioassay

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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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 Synonyms

2-Hydroxy-1.3-dimethyl-5-tert.-butyl-benzol
2,4-tert-butyl
2,6-dimethyl-4-tert-butylphenol
4-tert-Butyl-2,6-dimethyl-phenol
4-t-butyl-2,6-dimethylphenol
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