Butyl Benzoate (CAS 136-60-7) — formula C11H14O2, molecular weight 178.23.
Butyl Benzoate is a chemical compound with CAS registry number 136-60-7 and molecular formula C11H14O2 (molecular weight 178.23).
CAS number: 136-60-7
Its molecular formula C11H14O2 comprises 11 C, 14 H, 2 O atoms.
Also known as: Butyl Benzoate · n-BUTYLBENZOATE
The CAS registry number of Butyl Benzoate is 136-60-7.
Molecular formula C11H14O2, molecular weight 178.23.
It is also registered under: Butyl Benzoate, n-BUTYLBENZOATE.
Public-database records for Butyl Benzoate (CAS 136-60-7), reproduced here for independent cross-checking.
| GHS notification summary | 38.5% (209 / 543) |
|---|---|
| Reported hazard statements | H302 (16.6%), H315 (61.5%), H319 (61.3%) |
This chemical does not meet GHS hazard criteria for 38.5% (209 of 543) of reports.
H302 (16.6%): Harmful if swallowed [Warning Acute toxicity, oral]
| Regulatory & Food Contact | EU Flavoring substances FDA Inventory of Food Contact Substances Listed in 21 CFR: FCS Flavoring Agents CIR / INCI: Cosmetic ingredients (Butyl Benzoate) -> CIR (Cosmetic Ingredient Review) CIR / INCI: Preservative |
|---|---|
| GHS notification summary | 38.5% (209 / 543) |
| 沸点 | 250 °C |
|---|---|
| 熔点 | -22 °C |
| 闪点 | 225 °F (107 °C) (OPEN CUP) |
| 密度 | 1.00 @ 20 °C |
| Vapor 密度 | 6.15 (AIR= 1) |
| 蒸气压 | 0.01 [mmHg] |
| 蒸气压 | 0.01 mm Hg at 25 °C. |
| LogP | 3.68 |
| Other Experimental Properties | LESS THAN 0.01 MM HG @ 20 °C |
| CAS Registry Number | 136-60-7 |
|---|---|
| PubChem CID | 8698 |
| 分子式 | C11H14O2 |
| IUPAC 名称 | butyl benzoate |
| UNII(FDA) | 1TGZ0D0O8I |
BUTYL BENZOATE; n-Butyl benzoate; Benzoic acid, butyl ester; Anthrapole AZ; Dai Cari XBN; Benzoic acid n-butyl ester; Butylester kyseliny benzoove; HSDB 2089; Marvanol Carrier BB; 1TGZ0D0O8I; NSC 8474; EINECS 205-252-7; DTXSID8040694; UNII-1TGZ0D0O8I; NSC-8474; Butyl ester of benzoic acid
| 分子量 | 178.23 |
|---|---|
| XLogP3 | 3.8 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 5 |
| 精确质量 | 178.099379685 |
| 单同位素质量 | 178.099379685 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 13 |
| 形式电荷 | 0 |
Butyl Benzoate · CAS 136-60-7 · C11H14O2. UNII 1TGZ0D0O8I. 沸点: 250 °C; 熔点: -22 °C; 闪点: 225 °F (107 °C) (OPEN CUP).
Source: PubChem / Wikidata; the batch COA governs where values differ.
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