METHYL SORBATE (CAS 689-89-4) — formula C7H10O2, molecular weight 126.07 g/mol.
| CAS Number | 689-89-4 |
|---|---|
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.07 g/mol |
| Melting Point | 5 °C |
| Boiling Point | 180.00 °C. @ 760.00 mm Hg |
| LogP | 1.6 |
METHYL SORBATE is a chemical compound with CAS registry number 689-89-4 and molecular formula C7H10O2 (molecular weight 126.07 g/mol).
CAS number: 689-89-4
Its molecular formula C7H10O2 comprises 7 C, 10 H, 2 O atoms.
Also known as: METHYL SORBATE · 山梨酸甲酯
The CAS registry number of METHYL SORBATE is 689-89-4.
Molecular formula C7H10O2, molecular weight 126.07 g/mol.
It is also registered under: METHYL SORBATE, 山梨酸甲酯.
Independent reference data for METHYL SORBATE (CAS 689-89-4), compiled from public chemistry databases.
| CAS 号 | 689-89-4 |
|---|---|
| PubChem CID | 5323650 |
| 分子式 | C7H10O2 |
| 分子量 | 126.07 g/mol |
| IUPAC 名称 | methyl (2E,4E)-hexa-2,4-dienoate |
| InChIKey | KWKVAGQCDSHWFK-VNKDHWASSA-N |
| UNII（FDA） | J3048615R1 |
| ChEBI 编号 | CHEBI:184593 |
| FEMA 编号 | 3714 |
| JECFA 编号 | 1177 |
| Molecular Weight | 126.15 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 126.068079557 |
| Monoisotopic Mass | 126.068079557 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 9 |
| Boiling Point | 180.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 180 °C |
| Melting Point | 5 °C |
| Density | 0.933-0.938 |
| Refractive Index | 1.501-1.505 |
Methyl sorbate; 689-89-4; methyl (2E,4E)-hexa-2,4-dienoate; Sorbic acid, methyl ester; Methyl (E,E)-sorbate; Methyl (2E,4E)-hexadienoate; FEMA No. 3714; 2-trans,4-trans-Methyl sorbate; 2-trans-4-trans-Methyl sorbate; Methyl trans,trans-sorbate; Methyl (E,E)-hexa-2,4-dienoate; Methyl sorbate, (E,E)-; Sorbic acid, methyl ester, (E,E)-; METHYL SORBATE [FHFI]; 2,4-HEXADIENOIC ACID, METHYL ESTER, (E,E)-; AI3-30202
| 法规与食品接触 | 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 通报统计 | 70% (91 / 130) |
| GHS 通报统计 | 70% (91 / 130) |
|---|---|
| 已通报的危害声明 | H315 (30%), H319 (30%) |
山梨酸甲酯 的 CAS 号为 689-89-4，分子式 C7H10O2，分子量 126.07 g/mol。 UNII J3048615R1; ChEBI 184593; InChIKey KWKVAGQCDSHWFK-VNKDHWASSA-N. Boiling Point: 180.00 °C. @ 760.00 mm Hg; Boiling Point: 180 °C; Melting Point: 5 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 山梨酸甲酯