Benzoic acid, 4-((1-oxodecyl)oxy)-

HCID 3608562CAS 86960-46-5

基本信息

标准SMILES: CCCCCCCCCC(=O)Oc1ccc(C(=O)O)cc1
InChIKey: QTMHHQFADWIZCP-UHFFFAOYSA-N
分子式: C17H24O4
平均分子量: 292.4 g/mol
单同位素质量: 292.16745925

名称与标识

首选名称: Benzoic acid, 4-((1-oxodecyl)oxy)-
IUPAC: 4-decanoyloxybenzoic acid
中文名: 4-DECANOYLOXYBENZOIC ACID
英文名: 4-Decanoyloxy benzoic acid
分子式: C17H24O4
分子量: 292.37

名称与别名

86960-46-5Benzoic acid, 4-[(1-oxodecyl)oxy]-EC 617-941-3Benzoic acid, 4-((1-oxodecyl)oxy)-Benzoic acid, 4-((1-oxodecyl) oxy)-Benzoic acid, 4-[(1-oxodecyl) oxy]-RefChem:565835617-941-34-decanoyloxybenzoic Acid4-(DECANOYLOXY)BENZOIC ACIDMFCD010996314-n-decanoyloxybenzoic acid

展开更多名称

4-癸酰氧基苯甲酸4-Decanoyloxy benzoic acid

Benzoic acid, 4-( (1-oxodecyl) oxy)-p-decanoyloxybenzoic acidPara-Decanoyloxybenzoic AcidSCHEMBL1676854-n-nonylcarbonyloxybenzoic acidDTXSID603941344-(DECANOYLOXY)BENZOICACIDSBB056885

数据库标识

CAS: 86960-46-5
PubChem CID: 3608562
DTXSID: DTXSID60394134
EC Number: 617-941-3
Nikkaji: J1.638.522K

性质

结构计算性质

XLogP: 5.3
极性表面积: 63.6 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 11
重原子: 21
形式电荷: 0
复杂度: 306

物理化学性质

沸点: 430 ℃[at · 430℃[at 101 325 Pa]
密度: 1.14 · 1.14[at 20℃]
蒸气压: 0.001 Pa · 0.001Pa at 25℃
水溶解性: 1.1 mg/L · 1.1mg/L at 20℃
LogP: 4 at · 4 at 20℃
EPA化学物质信息: 4 · 4-Decanoyloxybenzoic acid (86960-46-5)

安全与法规

GHS分类

GHS Classification · 3 条

This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.

Not Classified

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.

危害信息

Regulatory Information · 2 条

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Cease Manufacture Update: 08-04-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/5452

Hazard Classes and CategoriesNot Classified

安全数据

tsca: TSCA listed

化学与工业

用途与制造

General Manufacturing InformationBenzoic acid, 4-[(1-oxodecyl)oxy]-: ACTIVE

供应商10 家

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

天津狄克特科技有限公司22-58627059 13920586291 · [email protected]

南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]

广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]

上海纳孚生物科技有限公司021-58952328 13125124762

关联笔记

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