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丙酸2-苯乙酯

CAS 122-70-3C11H14O2MW 178.23

丙酸2-苯乙酯(CAS 122-70-3):分子式 C11H14O2、分子量 178.23。

产品概览

CAS号122-70-3
分子式C11H14O2
分子量178.23
熔点< 25 °C
沸点244.00 to 245.00 °C. @ 760.00 mm Hg
LogP2.8

技术档案

这个产品是什么

丙酸2-苯乙酯 是一种化工化合物,登记 CAS 号为 122-70-3,分子式 C11H14O2(分子量 178.23)。

识别信息

登记 CAS 号:122-70-3

其分子式 C11H14O2 由 11 个碳、14 个氢、2 个氧 组成。

别名/同义词:丙酸2-苯乙酯 · PHENYL ETHYL PROPIONATE · 2-phenylethyl propionate · Phenethyl propionate

常见问题

丙酸2-苯乙酯 的 CAS 号是多少?

丙酸2-苯乙酯 的 CAS 登记号为 122-70-3。

丙酸2-苯乙酯 的分子式与分子量是多少?

分子式 C11H14O2,分子量 178.23。

丙酸2-苯乙酯 还有哪些别名?

别名/同义词:丙酸2-苯乙酯、PHENYL ETHYL PROPIONATE、2-phenylethyl propionate、Phenethyl propionate。

PubChem 公开数据

丙酸2-苯乙酯(CAS 122-70-3)的独立参考数据,整理自公开化学数据库。

各数据库的登记标识

CAS Registry Number122-70-3
PubChem CID31225
Molecular formulaC11H14O2
Molecular weight178.10 g/mol
IUPAC name2-phenylethyl propanoate
InChIKeyHVGZQCSMLUDISR-UHFFFAOYSA-N
UNII (FDA)9VFI60EUHW
ChEBI IDCHEBI:173825
FEMA number2867
JECFA number990

计算分子描述符

Molecular Weight178.23
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass178.099379685
Monoisotopic Mass178.099379685
Topological Polar Surface Area26.3
Heavy Atom Count13

在册的理化数值

Boiling Point244.00 to 245.00 °C. @ 760.00 mm Hg
Boiling Point244-245 °C
Melting Point< 25 °C
Density1.02 at 25/25 °C
Density1.010-1.021
Vapor Pressure0.05 [mmHg]
Refractive Index1.489-1.499

在册的记载用途

    Used as an insect attractant of Japanese beetles in orchards; [HSDB] Used as flavoring agent or adjuvant; [ToxPlanet: FDA]...Used widely for monitoring new infestations of the Japanese beetle Popillia japonica and for removal trapping in orchards.

    同义词与商品名

    2-Phenylethyl propionate; 122-70-3; Phenethyl propionate; 2-Phenylethyl propanoate; Propanoic acid, 2-phenylethyl ester; Phenylethyl propionate; Caswell No. 655D; FEMA No. 2867; UNII-9VFI60EUHW; NSC-404457; HSDB 7428; EINECS 204-567-7; phenyl ethyl propionate; DTXSID6035156; EPA Pesticide Chemical Code 102601; BRN 2097455

    已收录的法规名录

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Floral
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary100% (1564 / 1564)

    GHS 危害分类

    GHS notification summary100% (1564 / 1564)

    This chemical does not meet GHS hazard criteria for 100% (1564 of 1564) of all reports.

    Reported as not meeting GHS hazard criteria by 1564 of 1564 companies. For more detailed information, please visit ECHA C&L website.

    公开数据库对它的描述

    Phenethyl propionate is identified by CAS 122-70-3, molecular formula C11H14O2 and molecular weight 178.10 g/mol. UNII 9VFI60EUHW; ChEBI 173825; InChIKey HVGZQCSMLUDISR-UHFFFAOYSA-N. Boiling Point: 244.00 to 245.00 °C. @ 760.00 mm Hg; Boiling Point: 244-245 °C; Melting Point: < 25 °C.

    物理形态与操作说明

    数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。

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English page: PHENYL ETHYL PROPIONATE

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