2-methylbutyl 2-methylbutyrate (CAS 2445-78-5) — formula C10H20O2, molecular weight 172.15 g/mol; category organic chemicals.
2-methylbutyl 2-methylbutyrate (CAS 2445-78-5) is a organic chemicals. Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms. Its molecular weight is about 172.15 g/mol. Reported physicochemical data: boiling point around 70.00 to 72.00 °C. @ 11.00 mm Hg, LogP about 3.2. Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries. Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 2445-78-5 |
|---|---|
| Molecular Formula | C10H20O2 |
| Molecular Weight | 172.15 g/mol |
| Boiling Point | 70.00 to 72.00 °C. @ 11.00 mm Hg |
| LogP | 3.2 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering |
| Category | Organic Chemicals|Flavors |
Documented applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
2-methylbutyl 2-methylbutyrate is a carbon-based organic compound with CAS registry number 2445-78-5 and molecular formula C10H20O2 (molecular weight 172.15 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2445-78-5
Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms.
Also known as: 2-methylbutyl 2-methylbutyrate · 2- 甲基丁酸 2- 甲基丁酯
Category: organic chemicals / food flavors
The CAS registry number of 2-methylbutyl 2-methylbutyrate is 2445-78-5.
Molecular formula C10H20O2, molecular weight 172.15 g/mol.
It is also registered under: 2-methylbutyl 2-methylbutyrate, 2- 甲基丁酸 2- 甲基丁酯.
Recorded applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
Category: Organic Chemicals / Flavors.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for 2-methylbutyl 2-methylbutyrate (CAS 2445-78-5), compiled from public chemistry databases.
| CAS Registry Number | 2445-78-5 |
|---|---|
| PubChem CID | 17129 |
| Molecular formula | C10H20O2 |
| Molecular weight | 172.15 g/mol |
| IUPAC name | 2-methylbutyl 2-methylbutanoate |
| InChIKey | PVYFCGRBIREQLL-UHFFFAOYSA-N |
| UNII (FDA) | HYC739X7BP |
| ChEBI ID | CHEBI:179543 |
| FEMA number | 3359 |
| JECFA number | 212 |
| Molecular Weight | 172.26 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 172.146329876 |
| Monoisotopic Mass | 172.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
| Boiling Point | 70.00 to 72.00 °C. @ 11.00 mm Hg |
|---|---|
| Boiling Point | 184-187 °C |
| Density | 0.854-0.864 |
| Refractive Index | 1.409-1.509 |
2-METHYLBUTYL 2-METHYLBUTYRATE; 2-Methylbutyl 2-methylbutanoate; Butanoic acid, 2-methyl-, 2-methylbutyl ester; FEMA No. 3359; UNII-HYC739X7BP; HYC739X7BP; 2-methyl butyl 2-methyl butyrate; EINECS 219-497-2; 2-Methylbutanoic acid 2-methylbutyl ester; 2-methylbutanoic acid 2-methyl butyl ester; FEMA 3359; DTXSID40862947; 2-Methyl buthyl 2-methyl butanoate; 2-METHYLBUTYL 2-METHYLBUTYRATE [FHFI]; 2-METHYL BUTANOIC ACID-2-METHYL BUTYL ESTER; RefChem:88272
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Apple, Berry, Rum No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 7.2% (12 / 167) |
| GHS notification summary | 7.2% (12 / 167) |
|---|---|
| Reported hazard statements | H411 (92.8%) |
This chemical does not meet GHS hazard criteria for 7.2% (12 of 167) of reports.
H411 (92.8%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
2-methylbutyl 2-methylbutyrate is identified by CAS 2445-78-5, molecular formula C10H20O2 and molecular weight 172.15 g/mol. UNII HYC739X7BP; ChEBI 179543; InChIKey PVYFCGRBIREQLL-UHFFFAOYSA-N. Boiling Point: 70.00 to 72.00 °C. @ 11.00 mm Hg; Boiling Point: 184-187 °C; Density: 0.854-0.864.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2- 甲基丁酸 2- 甲基丁酯