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4-Hydroxybenzoic Acid Butyl Ester

CAS 94-26-8C11H14O3MW 194.23

4-Hydroxybenzoic Acid Butyl Ester(CAS 94-26-8):分子式 C11H14O3、分子量 194.23;类别 有机化学品。

产品概览

CAS号94-26-8
分子式C11H14O3
分子量194.23
熔点154 to 156 °F (NTP, 1992)
沸点156.00 to 157.00 °C. @ 3.50 mm Hg
LogPlog Kow = 3.57
类别Organic Chemicals

技术档案

这个产品是什么

4-Hydroxybenzoic Acid Butyl Ester 是一种以碳骨架为基础的有机化合物,登记 CAS 号为 94-26-8,分子式 C11H14O3(分子量 194.23),归属于有机化学品大类化工原料。

识别信息

登记 CAS 号:94-26-8

其分子式 C11H14O3 由 11 个碳、14 个氢、3 个氧 组成。

别名/同义词:4-Hydroxybenzoic Acid Butyl Ester · Butylparaben · n-Butyl 4-hydroxybenzoate

所属分类:有机化学品

常见问题

4-Hydroxybenzoic Acid Butyl Ester 的 CAS 号是多少?

4-Hydroxybenzoic Acid Butyl Ester 的 CAS 登记号为 94-26-8。

4-Hydroxybenzoic Acid Butyl Ester 的分子式与分子量是多少?

分子式 C11H14O3,分子量 194.23。

4-Hydroxybenzoic Acid Butyl Ester 还有哪些别名?

别名/同义词:4-Hydroxybenzoic Acid Butyl Ester、Butylparaben、n-Butyl 4-hydroxybenzoate。

4-Hydroxybenzoic Acid Butyl Ester 属于哪个分类?

所属分类:Organic Chemicals。

PubChem 公开数据

4-Hydroxybenzoic Acid Butyl Ester(CAS 94-26-8)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 Number94-26-8
PubChem CID7184
Molecular formulaC11H14O3
IUPAC namebutyl 4-hydroxybenzoate
UNII (FDA)3QPI1U3FV8
FEMA number2203
JECFA number870

计算分子描述符

Molecular Weight194.23
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass194.094294304
Monoisotopic Mass194.094294304
Topological Polar Surface Area46.5
Heavy Atom Count14

在册的理化数值

Boiling Point156.00 to 157.00 °C. @ 3.50 mm Hg
Boiling Point156-157 °C (3.5 mm Hg)
Melting Point154 to 156 °F (NTP, 1992)
Melting Point68.5 °C
Melting Point68 - 69 °C
Flash Point181 °C
SolubilityIn water, 2.07X10+2 mg/L at 20 °C
Solubility0.207 mg/mL at 20 °C
Vapor Pressure0.000186 [mmHg]
LogPlog Kow = 3.57

在册的记载用途

    Used as an antifungal agent, preservative in antiseptic creams, food preservative, and pharyngeal antiseptic; [HSDB] The parabens (methyl, ethyl, propyl, and butyl) were the most widely used preservatives in cosmetics (0.1% to 0.8%) until their sensitizing potential was recognized; [Marks, p. 115]Table: Reported uses (ppm): (Flavor and Extract Manufacturers' Association, 1994) [Table#984]

    同义词与商品名

    BUTYLPARABEN; Butyl 4-hydroxybenzoate; 94-26-8; Butyl paraben; Butyl p-hydroxybenzoate; Butoben; Nipabutyl; Butyl chemosept; Butyl parasept; Tegosept B; Butyl tegosept; Butyl butex; Aseptoform butyl; Solbrol B; Butyl parahydroxybenzoate; n-Butyl p-hydroxybenzoate

    已收录的法规名录

    Regulatory & Food ContactFDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    FLAVOURING_AGENTFood Additives -> PRESERVATIVE: Flavouring Agent
    Flavoring Agents
    No safety concern at current levels of intake when used as a flavouring agent
    TRS 913-JECFA 59/112
    FAS 48-JECFA 57/273 (2001)
    GHS notification summary35.6% (479 / 1344)

    GHS 危害分类

    GHS notification summary35.6% (479 / 1344)
    Reported hazard statementsH315 (60.4%), H318 (21.6%), H319 (41.6%), H335 (39.7%), H412 (18.2%)

    This chemical does not meet GHS hazard criteria for 35.6% (479 of 1344) of reports.

    H315 (60.4%): Causes skin irritation [Warning Skin corrosion/irritation]

    公开数据库对它的描述

    4-Hydroxybenzoic Acid Butyl Ester · CAS 94-26-8 · C11H14O3. UNII 3QPI1U3FV8. Boiling Point: 156.00 to 157.00 °C. @ 3.50 mm Hg; Boiling Point: 156-157 °C (3.5 mm Hg); Melting Point: 154 to 156 °F (NTP, 1992).

    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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