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2,5-Di-tert-butylhydroquinone structure, CAS 88-58-4

2,5-Di-tert-butylhydroquinone

CAS Number88-58-4

Synonyms2,5-Bis(2-methyl-2-propanyl)-1,4-benzenediol; MFCD00008825; 2,5-TBHQ; EINECS 201-841-8; 2,5-Di-tert-Butyl-1,4-hydroquinone (DBHQ); 2,5-di-tert-butylhydroquinone; 2,5-Di-tert-butylbenzene-1,4-diol; 2,5-DITERT-BUTYLBENZENE-1,4-DIOL; 2,5-Di-tert-butyl-1,4-hydroquinone

Molecular Formula[(CH3)3C]2C6H2-1,4-(OH)2

Molecular Weight222.32

Purity99%

Density1.0±0.1 g/cm3

Boiling Point334.4±37.0 °C at 760 mmHg

Melting Point216-218 °C (lit.)

Flash Point

Appearancesolid

EINECS201-841-8

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9017574 Purity: 99%
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Chemical & Physical Properties
CAS Number88-58-4
Catalog No.2A-9017574
Chinese Name2,5-二叔丁基对苯二酚
Synonyms2,5-Bis(2-methyl-2-propanyl)-1,4-benzenediol; MFCD00008825; 2,5-TBHQ; EINECS 201-841-8; 2,5-Di-tert-Butyl-1,4-hydroquinone (DBHQ); 2,5-di-tert-butylhydroquinone; 2,5-Di-tert-butylbenzene-1,4-diol; 2,5-DITERT-BUTYLBENZENE-1,4-DIOL; 2,5-Di-tert-butyl-1,4-hydroquinone
Molecular Formula[(CH3)3C]2C6H2-1,4-(OH)2
Molecular Weight222.32
Purity99
Density1.0±0.1 g/cm3
Boiling Point334.4±37.0 °C at 760 mmHg
Melting Point216-218 °C (lit.)
Appearancesolid
Water SolubilityWater solubility: insoluble; water solubility: 0.0
Storage ConditionThis product should be stored in a sealed, cool, d
Application2,5-Di-tert-butylhydroquinone (DTBHQ) is an indirect food additive that modulates 5-LO and COX-2 activities with IC50 of 1.8 and 14.1 μM, respectively.
EINECS201-841-8
HTC29072900
PubChem ID24847124
MDL NumberMFCD00008825
SMILESCC(C)(C)c1cc(O)c(cc1O)C(C)(C)C
InChI1S/C14H22O2/c1-13(2,3)9-7-12(16)10(8-11(9)15)14(4,5)6/h7-8,15-16H,1-6H3
InChI KeyJZODKRWQWUWGCD-UHFFFAOYSA-N
Beilstein/REAXYS2049542
NACRES CodeNA.22
UNSPSC12352100
Hazard SymbolsTransport
MSDSmsds/17574_2_88_58_4.pdf
Bioactivity2,5-Di-tert-butylhydroquinone (DTBHQ), the indirect food additive, regulates the activity of 5-lipoxygenase as well as the activity of COX-2 (IC50=1.8 and 14.1 μM for 5-LO and COX-2, respectively) [1]. Related Catalog Research Areas >> Inflammation/Immunology Signaling Pathways >> Metabolic Enzyme/Protease >> 5-Lipoxygenase Signaling Pathways >> Immunology/Inflammation >> COX Target 5-LO:1.8 μM (IC50) COX-2:14.1 μM (IC50) In Vitro DTBHQ influences arachidonic acid (AA) metabolism in biologically relevant concentrations in vitro[1]. References [1]. Zsofia Kutil, et al. The influence of the quinone antioxidants tert-butylhydroquinone and 2,5-di-tert-butylhydroquinone on the arachidonic acid metabolism in vitro. Food and Agricultural Immunology. Volume 26, 2015-Issue 4. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 334.4±37.0 °C at 760 mmHg Melting Point 216-218 °C(lit.) Molecular Formula C14H22O2 Molecular Weight 222.323 Flash Point 151.5±21.1 °C Exact Mass 222.161987 PSA 40.46000 LogP 4.02 Vapour Pressure 0.0±0.8 mmHg at 25°C Index of Refraction 1.520 InChIKey JZODKRWQWUWGCD-UHFFFAOYSA-N SMILES CC(C)(C)c1cc(O)c(C(C)(C)C)cc1O Storage condition Store at RT Stability Stable. Incompatible with oxidizing agents.
Use of2,5-Di-tert-butylhydroquinone (DTBHQ), the indirect food additive, regulates the activity of 5-lipoxygenase as well as the activity of COX-2 (IC50=1.8 and 14.1 μM for 5-LO and COX-2, respectively) [1]. Properties Articles30 Name 2,5-di-tert-butylbenzene-1,4-diol Synonym More Synonyms 2,5-Di-tert-butylhydroquinone Biological Activity Description 2,5-Di-tert-butylhydroquinone (DTBHQ), the indirect food additive, regulates the activity of 5-lipoxygenase as well as the activity of COX-2 (IC50=1.8 and 14.1 μM for 5-LO and COX-2, respectively) [1]. Related Catalog Research Areas >> Inflammation/Immunology Signaling Pathways >> Metabolic Enzyme/Protease >> 5-Lipoxygenase Signaling Pathways >> Immunology/Inflammation >> COX 5-LO:1.8 μM (IC50) COX-2:14.1 μM (IC50) In Vitro DTBHQ influences arachidonic acid (AA) metabolism in biologically relevant concentrations in vitro[1]. References [1]. Zsofia Kutil, et al. The influence of the quinone antioxidants tert-butylhydroquinone and 2,5-di-tert-butylhydroquinone on the arachidonic acid metabolism in vitro. Food and Agricultural Immunology. Volume 26, 2015-Issue 4. Chemical & Physical Properties Molecular Formula C14H22O2 Exact Mass 222.161987 PSA 40.46000 Index of Refraction 1.520 InChIKey JZODKRWQWUWGCD-UHFFFAOYSA-N Storage condition Store at RT Stability Stable. Incompatible with oxidizing agents.
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SupervisionA. Customs clearance form for inbound goods B. Customs clearance form for outbound goods
InspectionR. Imported food hygiene supervision and inspection S. Export food hygiene supervision and inspection M. Imported commodity inspection N. Exported commodity inspection
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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