ISOBUTYL BENZOATE (CAS 120-50-3) — formula C11H14O2, molecular weight 178.10 g/mol; category food flavors.
ISOBUTYL BENZOATE (CAS 120-50-3) is a chemical raw material in the food flavors category. Its molecular formula C11H14O2 comprises 11 C, 14 H, 2 O atoms. Its molecular weight is about 178.10 g/mol. Reported physicochemical data: boiling point around 242.00 °C. @ 760.00 mm Hg, LogP about 3.230. 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 | 120-50-3 |
|---|---|
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.10 g/mol |
| Boiling Point | 242.00 °C. @ 760.00 mm Hg |
| LogP | 3.230 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | 典型应用领域：食品增香, 日化。规格/纯度：以批次 COA 为准。包装：25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 密封保存 |
| Category | Flavors & Fragrances|Flavors |
Documented applications: 典型应用领域：食品增香, 日化。规格/纯度：以批次 COA 为准。包装：25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 密封保存.
ISOBUTYL BENZOATE is a flavoring compound with CAS registry number 120-50-3 and molecular formula C11H14O2 (molecular weight 178.10 g/mol), belonging to the food flavors segment of chemical raw materials.
CAS number: 120-50-3
Its molecular formula C11H14O2 comprises 11 C, 14 H, 2 O atoms.
Also known as: ISOBUTYL BENZOATE · 苯甲酸异丁酯
Category: food flavors / food flavors
The CAS registry number of ISOBUTYL BENZOATE is 120-50-3.
Molecular formula C11H14O2, molecular weight 178.10 g/mol.
It is also registered under: ISOBUTYL BENZOATE, 苯甲酸异丁酯.
Recorded applications: 典型应用领域：食品增香, 日化。规格/纯度：以批次 COA 为准。包装：25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 密封保存.
Category: Flavors & Fragrances / 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 ISOBUTYL BENZOATE (CAS 120-50-3), compiled from public chemistry databases.
| CAS Number | 120-50-3 |
|---|---|
| PubChem CID | 61048 |
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.10 g/mol |
| IUPAC Name | 2-methylpropyl benzoate |
| InChIKey | KYZHGEFMXZOSJN-UHFFFAOYSA-N |
| UNII (FDA) | KQ6XZ9WJII |
| Molecular Weight | 178.23 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 178.099379685 |
| Monoisotopic Mass | 178.099379685 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 13 |
| Boiling Point | 242.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 240 °C |
| Density | 0.994-0.999 |
| LogP | 3.230 |
| Refractive Index | 1.489-1.496 |
Isobutyl benzoate; 120-50-3; 2-Methylpropyl benzoate; BENZOIC ACID, 2-METHYLPROPYL ESTER; Benzoic acid, isobutyl ester; FEMA No. 2185; DTXSID6047074; KQ6XZ9WJII; NSC-6580; DTXCID4027074; CHEBI:87500; RefChem:791620; 204-401-3; Benzoic Acid Isobutyl Ester; MFCD00048344; Benzoic acid-(2-methylpropyl) ester
| Regulatory & food contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notifications | 100% (1572 / 1572) |
| GHS notifications | 100% (1572 / 1572) |
|---|
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 苯甲酸异丁酯