CAS Number3602-55-9
SynonymsEINECS 222-757-8; 2-tert-butylcyclohexa-2,5-diene-1,4-dione; MFCD00666928
Molecular Formula(CH3)3CC6H3(=O)2
Molecular Weight164.20
Purity98%
Density1.092 g/cm3
Boiling Point227.8ºC at 760 mmHg
Melting Point54-58 °C (lit.)
Appearancesolid
EINECS222-757-8
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3602-55-9 |
| Catalog No. | 2A-9029980 |
| Chinese Name | 叔丁基对苯醌 |
| Synonyms | EINECS 222-757-8; 2-tert-butylcyclohexa-2,5-diene-1,4-dione; MFCD00666928 |
| Molecular Formula | (CH3)3CC6H3(=O)2 |
| Molecular Weight | 164.20 |
| Purity | 98 |
| Density | 1.092 g/cm3 |
| Boiling Point | 227.8ºC at 760 mmHg |
| Melting Point | 54-58 °C (lit.) |
| Appearance | solid |
| Storage Condition | Keep away from light, in a ventilated and dry plac |
| Application | 2-tert-Butyl-1,4-benzoquinone is the electrophilic metabolite of butylated hydroxyanisole and the oxidation product of 2-tert-butylhydroquinone [1]. |
| EINECS | 222-757-8 |
| HTC | 2914690090 |
| PubChem ID | 24866835 |
| MDL Number | MFCD00666928 |
| SMILES | CC(C)(C)C1=CC(=O)C=CC1=O |
| InChI | 1S/C10H12O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6H,1-3H3 |
| InChI Key | NCCTVAJNFXYWTM-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| MSDS | msds/29980_1_3602_55_9.pdf |
| Bioactivity | 2-tert-Butyl-1,4-benzoquinone is an electrophilic metabolite of butylated hydroxyanisole and an oxidation product of 2-tert-butylhydroquinone[1]. Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Research Areas >> Cancer Chemical & Physical Properties Density 1.092 g/cm3 Boiling Point 227.8ºC at 760 mmHg Melting Point 54-58 °C(lit.) Molecular Formula C10H12O2 Molecular Weight 164.20100 Flash Point 82.6ºC Exact Mass 164.08400 PSA 34.14000 LogP 1.66690 Index of Refraction 1.515 InChIKey NCCTVAJNFXYWTM-UHFFFAOYSA-N SMILES CC(C)(C)C1=CC(=O)C=CC1=O |
| Use of | 2-tert-Butyl-1,4-benzoquinone is an electrophilic metabolite of butylated hydroxyanisole and an oxidation product of 2-tert-butylhydroquinone[1]. Properties Articles22 Name 2-tert-Butyl-1,4-benzoquinone Synonym More Synonyms 2-tert-Butyl-1,4-benzoquinone Biological Activity Description 2-tert-Butyl-1,4-benzoquinone is an electrophilic metabolite of butylated hydroxyanisole and an oxidation product of 2-tert-butylhydroquinone[1]. Related Catalog Signaling Pathways >> Apoptosis >> Apoptosis Research Areas >> Cancer Chemical & Physical Properties Molecular Formula C10H12O2 Exact Mass 164.08400 PSA 34.14000 LogP 1.66690 Index of Refraction 1.515 InChIKey NCCTVAJNFXYWTM-UHFFFAOYSA-N SMILES CC(C)(C)C1=CC(=O)C=CC1=O |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: No dangerous goods IMDG Code: No dangerous goods International Air Transport Dangerous Regulations: No 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 Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special precautions for users No data available |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| Methandriol dipropionate | 3593-85-9 | 2A-9029969 |
| 2-(4-Chlorophenoxy)acetonitrile | 3598-13-8 | 2A-9029971 |
| Sodium phenoxyacetate | 3598-16-1 | 2A-9029972 |
| 3,4,5-Trithiaheptane | 3600-24-6 | 2A-9029974 |
| 1-Chloro-3,5-di(4-chlorbenzoyl)-2-deoxy-D-ribose | 3601-90-9 | 2A-9029979 |
| Methyl 4-acetylbenzoate | 3609-53-8 | 2A-9029983 |
| 6-Methoxytryptamine | 3610-36-4 | 2A-9029984 |
| 7-Methoxy-3,7-dimethyloctanal | 3613-30-7 | 2A-9029987 |
| Dimebolin | 3613-73-8 | 2A-9029988 |
| Isopyrin | 3615-24-5 | 2A-9029989 |
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