2-Hydroxybenzoic acid phenylmethyl ester (CAS 118-58-1) — formula C14H12O3, molecular weight 228.24; category organic chemicals.
2-Hydroxybenzoic acid phenylmethyl ester is a carbon-based organic compound with CAS registry number 118-58-1 and molecular formula C14H12O3 (molecular weight 228.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 118-58-1
Its molecular formula C14H12O3 comprises 14 C, 12 H, 3 O atoms.
Also known as: 2-Hydroxybenzoic acid phenylmethyl ester · Benzyl Salicylate
Category: organic chemicals
The CAS registry number of 2-Hydroxybenzoic acid phenylmethyl ester is 118-58-1.
Molecular formula C14H12O3, molecular weight 228.24.
It is also registered under: 2-Hydroxybenzoic acid phenylmethyl ester, Benzyl Salicylate.
Category: Organic Chemicals.
Public-database records for 2-Hydroxybenzoic acid phenylmethyl ester (CAS 118-58-1), reproduced here for independent cross-checking.
| GHS 通报统计 | 0.4% (9 / 2207) |
|---|---|
| 已通报的危害声明 | H317, H319 (76.2%), H411 (24.1%), H412 (68.4%), H320, H361, H401, H371 |
| 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 Honey No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS 通报统计 | 0.4% (9 / 2207) |
| 沸点 | 406 °F at 26 mmHg (NTP, 1992) |
|---|---|
| 沸点 | 320 °C |
| 沸点 | BP: 211 °C at 2.67 kPa |
| 沸点 | 208.00 °C. @ 26.00 mm Hg |
| 沸点 | 300 °C |
| 熔点 | 75 °F (NTP, 1992) |
| 熔点 | 24 °C |
| 熔点 | 23.4 °C |
| 闪点 | 180 °C (356 °F) - closed cup |
| 闪点 | >212 °F (>100 °C) - closed cup |
| CAS 号 | 118-58-1 |
|---|---|
| PubChem CID | 8363 |
| 分子式 | C14H12O3 |
| 分子量 | 228.08 g/mol |
| IUPAC 名称 | benzyl 2-hydroxybenzoate |
| InChIKey | ZCTQGTTXIYCGGC-UHFFFAOYSA-N |
| UNII（FDA） | WAO5MNK9TU |
| ChEBI 编号 | CHEBI:165211 |
| FEMA 编号 | 2151 |
| JECFA 编号 | 904 |
BENZYL SALICYLATE; 118-58-1; Benzyl 2-hydroxybenzoate; Benzyl o-hydroxybenzoate; Salicylic Acid Benzyl Ester; Salicylic acid, benzyl ester; Phenylmethyl 2-hydroxybenzoate; FEMA No. 2151; Benzoic acid, 2-hydroxy-, phenylmethyl ester; Salicylsaeurebenzylester; 2-Hydroxybenzoic acid phenylmethyl ester; Salicyclic acid, benzyl ester; DTXSID1024598; WAO5MNK9TU; NSC-6647; DTXCID304598
| 分子量 | 228.24 |
|---|---|
| XLogP3 | 3.2 |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 4 |
| 精确质量 | 228.078644241 |
| 单同位素质量 | 228.078644241 |
| 拓扑极性表面积 | 46.5 |
| 重原子数 | 17 |
| 形式电荷 | 0 |
水杨酸苄酯 的 CAS 号为 118-58-1，分子式 C14H12O3，分子量 228.08 g/mol。 UNII WAO5MNK9TU; ChEBI 165211; InChIKey ZCTQGTTXIYCGGC-UHFFFAOYSA-N. 沸点: 406 °F at 26 mmHg (NTP, 1992); 沸点: 320 °C; 沸点: BP: 211 °C at 2.67 kPa.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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