2,2,5-TRIMETHYLHEXANE
2,2,5-TRIMETHYLHEXANE structure
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Common Name | 2,2,5-TRIMETHYLHEXANE | ||
|---|---|---|---|---|
| CAS Number | 3522-94-9 | Molecular Weight | 128.255 | |
| Density | 0.7±0.1 g/cm3 | Boiling Point | 123.6±7.0 °C at 760 mmHg | |
| Molecular Formula | C9H20 | Melting Point | -116.8ºC | |
| MSDS | N/A | Flash Point | 19.8±11.7 °C | |
Summary: 2,2,5-Trimethylhexane (Chinese name: 2,2,5-三甲基己烷, CAS number: 3522-94-9) is an organic compound with molecular formula C9H20 and molecular weight 128.255. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,2,5-trimethylhexane |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 0.7±0.1 g/cm3 |
|---|---|
| Boiling Point | 123.6±7.0 °C at 760 mmHg |
| Melting Point | -116.8ºC |
| Molecular Formula | C9H20 |
| Molecular Weight | 128.255 |
| Flash Point | 19.8±11.7 °C |
| Exact Mass | 128.156494 |
| LogP | 4.99 |
| Vapour Pressure | 16.0±0.1 mmHg at 25°C |
| Index of Refraction | 1.407 |
| InChIKey | HHOSMYBYIHNXNO-UHFFFAOYSA-N |
| SMILES | CC(C)CCC(C)(C)C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Risk Phrases | R11:Highly Flammable. |
|---|---|
| Safety Phrases | S16-S26 |
| RIDADR | 3295 |
| RTECS | MO4630000 |
| HS Code | 2901100000 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 7 | |
CAS#:187737-37-7
CAS#:124030-73-5
CAS#:630-19-3
CAS#:107-82-4
CAS#:764-13-6
CAS#:507-20-0
CAS#:21261-07-4
CAS#:107-01-7
CAS#:78-78-4
CAS#:75-97-8
CAS#:14272-73-2
CAS#:14705-50-1
CAS#:40239-50-7
CAS#:1069-53-0
CAS#:66793-71-3
CAS#:7647-01-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2901100000 |
|---|---|
| Summary | 2901100000 saturated acyclic hydrocarbons。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:2.0%。General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Hexane,2,2,5-trimethyl |
| 2,2,5,6-TETRAMETHYL-4H-1,3-DIOXIN-4-ONE |
| 2,2,5-TRIMETHYLHEXANE |
| 2,2,5-trimethyl-hexane |
| 2,2,5-Trimethylhexan |
| EINECS 222-537-1 |
| MFCD00026525 |
| Hexane,2,5-trimethyl |
| 2,5-Trimethylhexane |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 2,2,5-trimethylhexane? |
| A: CAS number of 2,2,5-trimethylhexane is 3522-94-9. |
| Q: What is the molecular formula of 2,2,5-trimethylhexane? |
| A: Molecular formula of 2,2,5-trimethylhexane is C9H20. |
| Q: What is the SMILES notation of 2,2,5-trimethylhexane? |
| A: SMILES notation of 2,2,5-trimethylhexane is CC(C)CCC(C)(C)C. |
| Q: What is the safety information for 2,2,5-trimethylhexane? |
| A: Safety information for 2,2,5-trimethylhexane: S16-S26. |
| Q: What is the molecular weight of 2,2,5-trimethylhexane? |
| A: Molecular weight of 2,2,5-trimethylhexane is 128.255. |
| Q: What is the English name of 2,2,5-trimethylhexane? |
| A: The English name of 2,2,5-trimethylhexane is 2,2,5-trimethylhexane. |
| Q: What are the upstream materials of 2,2,5-trimethylhexane? |
| A: Related upstream materials(CAS) of 2,2,5-trimethylhexane: 187737-37-7;124030-73-5;630-19-3;107-82-4;764-13-6;507-20-0;21261-07-4;107-01-7;78-78-4. |
| Q: What is the boiling point of 2,2,5-trimethylhexane? |
| A: Boiling point of 2,2,5-trimethylhexane is 123.6±7.0 °C at 760 mmHg. |
| Q: What are the downstream products of 2,2,5-trimethylhexane? |
| A: Related downstream products(CAS) of 2,2,5-trimethylhexane: 75-97-8;14272-73-2;14705-50-1;40239-50-7;1069-53-0;66793-71-3;7647-01-0. |
| Q: What is the LogP of 2,2,5-trimethylhexane? |
| A: LogP of 2,2,5-trimethylhexane is 4.99. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |