Methyl 2-methylbutyrate
Methyl 2-methylbutyrate structure
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Common Name | Methyl 2-methylbutyrate | ||
|---|---|---|---|---|
| CAS Number | 868-57-5 | Molecular Weight | 116.158 | |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 112.6±8.0 °C at 760 mmHg | |
| Molecular Formula | C6H12O2 | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 32.2±0.0 °C | |
| Symbol |
GHS02 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Methyl DL-2-Methylbutyrate |
|---|---|
| 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 | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 112.6±8.0 °C at 760 mmHg |
| Molecular Formula | C6H12O2 |
| Molecular Weight | 116.158 |
| Flash Point | 32.2±0.0 °C |
| Exact Mass | 116.083733 |
| PSA | 26.30000 |
| LogP | 1.59 |
| Vapour Pressure | 21.6±0.2 mmHg at 25°C |
| Index of Refraction | 1.396 |
| InChIKey | OCWLYWIFNDCWRZ-UHFFFAOYSA-N |
| SMILES | CCC(C)C(=O)OC |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS02 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H226 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi |
| Risk Phrases | R11 |
| Safety Phrases | S16-S23-S33 |
| RIDADR | UN 3272 3/PG 3 |
| WGK Germany | 2 |
| Packaging Group | II |
| Hazard Class | 3 |
| HS Code | 2915600000 |
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 10 | |
|---|---|
| DownStream 9 | |
CAS#:67-56-1
CAS#:116-53-0
CAS#:591-50-4
CAS#:123820-43-9
CAS#:536-74-3
CAS#:590-18-1
CAS#:17094-21-2
CAS#:201230-82-2
CAS#:106-99-0
CAS#:41725-90-0
CAS#:81925-81-7
CAS#:32444-33-0
CAS#:5296-70-8
CAS#:41487-73-4
CAS#:3234-80-8
CAS#:82504-42-5
CAS#:13888-03-4
CAS#:58308-68-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2915900090 |
|---|---|
| Summary | 2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Chilling-related cell damage of apple (Malus × domestica Borkh.) fruit cortical tissue impacts antioxidant, lipid and phenolic metabolism.
Physiol. Plant. 153(2) , 204-20, (2015) 'Soggy breakdown' (SB) is an internal flesh disorder of 'Honeycrisp' apple (Malus × domestica Borkh.) fruit that occurs during low temperature storage. The disorder is a chilling injury (CI) in which ... |
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Potential pollinator-attracting chemicals fromVictoria (Nymphaeaceae). Kite G, et al.
Biochem. Syst. Ecol. 19(7) , 535-39, (1991)
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Volatile constituents of larval osmeterial secretions in Papilio protenor demetrius. Honda K.
J. Insect Physiol. 26(1) , 39-45, (1980)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Methyl α-methylbutanoate |
| Methyl 2-methylbutanoate |
| Butanoic acid, 2-methyl-, methyl ester |
| 2Y1&VO1 |
| Methyl 2-methylbutyrate |
| EINECS 212-778-0 |
| MFCD00009335 |
| Methyl α-methylbutyrate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of Methyl DL-2-Methylbutyrate? |
| A: Related upstream materials(CAS) of Methyl DL-2-Methylbutyrate: 67-56-1;116-53-0;591-50-4;123820-43-9;536-74-3;590-18-1;17094-21-2;201230-82-2;106-99-0;41725-90-0. |
| Q: What is the English name of Methyl DL-2-Methylbutyrate? |
| A: The English name of Methyl DL-2-Methylbutyrate is Methyl DL-2-Methylbutyrate. |
| Q: What is the SMILES notation of Methyl DL-2-Methylbutyrate? |
| A: SMILES notation of Methyl DL-2-Methylbutyrate is CCC(C)C(=O)OC. |
| Q: What is the LogP of Methyl DL-2-Methylbutyrate? |
| A: LogP of Methyl DL-2-Methylbutyrate is 1.59. |
| Q: What are the downstream products of Methyl DL-2-Methylbutyrate? |
| A: Related downstream products(CAS) of Methyl DL-2-Methylbutyrate: 81925-81-7;116-53-0;32444-33-0;5296-70-8;41487-73-4;3234-80-8;82504-42-5;13888-03-4;58308-68-2. |
| Q: What is the CAS number of Methyl DL-2-Methylbutyrate? |
| A: CAS number of Methyl DL-2-Methylbutyrate is 868-57-5. |
| Q: What is the molecular formula of Methyl DL-2-Methylbutyrate? |
| A: Molecular formula of Methyl DL-2-Methylbutyrate is C6H12O2. |
| Q: What is the molecular weight of Methyl DL-2-Methylbutyrate? |
| A: Molecular weight of Methyl DL-2-Methylbutyrate is 116.158. |
| Q: What is the safety information for Methyl DL-2-Methylbutyrate? |
| A: Safety information for Methyl DL-2-Methylbutyrate: S16-S23-S33. |
| Q: What is the polar surface area (PSA) of Methyl DL-2-Methylbutyrate? |
| A: Polar surface area (PSA) of Methyl DL-2-Methylbutyrate is 26.30000. |
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. |
| Henan Tianfu Chemical Co., Ltd. |