4-(4-Fluorobenzoyl)butyric acid (CAS 149437-76-3)

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4-(4-Fluorobenzoyl)butyric acid. CAS 149437-76-3. 1g.

⚠️ Note: This safety data sheet is provided in English; a localized version is being prepared.

Free, and generated automatically from the sources listed on this page. No person has reviewed it, and it describes the substance in general — not your material, your process or your intended market.

REACH 2020/878
v1 · 03.09.2026
Download Safety Data Sheet (PDF)CAS 149437-76-3 · PDF · 139 KBWorking draft — not yet reviewed and approved.

Section 9 — physicochemical properties: 1 of 22 established.

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化学概述: 4-(4-Fluorobenzoyl)butyric Acid
分子式C11H11FO3[1]
分子量210.2 g/mol[1]
LogP(亲脂性)1.8[1]
IUPAC名称5-(4-fluorophenyl)-5-oxopentanoic acid[1]
SMILESC1=CC(=CC=C1C(=O)CCCC(=O)O)F[1]
InChIKeyZBQROUOOMAMCQW-UHFFFAOYSA-N[1]

同义词: 149437-76-3 · 4-(4-Fluorobenzoyl)butyric Acid · 4-Fluoro-delta-oxobenzenepentanoic Acid · RefChem:514192 · DTXCID80302115

数据来源: PubChem (NLM/NIH)
最后更新: 2026-09-03

📚 科学参考文献(芝加哥作者-日期格式) (1 来源)
  1. PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. applies to: 分子式 · 分子量 · LogP(亲脂性) · IUPAC名称 · SMILES · InChIKey

科学研究

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MOLECULE 按CAS号参考文献(实时来自13+数据库)

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  3. db:crossref Xiaoran Zhao, Zicheng Ma, Yuyang Zhu et al.. (2026). "A green self-assembled hydrogel developed from glycyrrhizic acid and berberine for shelf-life extension and flavor quality preservation of strawberry fruits". Food Chemistry. https://doi.org/10.1016/j.foodchem.2026.149437
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物质监管状态
该物质受监管要求约束: 危险废物管理(BDO登记册). 详细信息请参见“法规状态(REACH/ECHA/CLP)”章节及安全数据表。 监管信息——不限制在本店购买。
🧪 化学数据
CAS号
149437-76-3
分子式
C11H11FO3
摩尔质量
210.20 g/mol
IUPAC名称 (EN)
5-(4-fluorophenyl)-5-oxopentanoic acid
SMILES
C1=CC(=CC=C1C(=O)CCCC(=O)O)F
InChIKey
ZBQROUOOMAMCQW-UHFFFAOYSA-N
🔍 外部标识符
6 / 16个ID系统38%
数据库标识符操作
CAS Registry Number149437-76-3打开 →
PubChem CID689096[1]打开 →
InChIKeyZBQROUOOMAMCQW-UHFFFAOYSA-N[1]打开 →
SMILESC1=CC(=CC=C1C(=O)CCCC(=O)O)F[1]
UNII (FDA)Q9WD9HE8J3打开 →
WikiData QIDQ72479232打开 →

来源:PubChem (NIH)、Wikidata SPARQL、KEGG、ChEMBL (EBI)、CompTox CTX (EPA)。

📚 科学参考文献(芝加哥作者-日期格式) (1 来源)
  1. PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. applies to: PubChem CID · InChIKey · SMILES

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4-(4-Fluorobenzoyl)butyric acid — CAS 149437-76-3, purity 0.97, 1g. Listed by Beijing Tong Guang. Prepared from the supplier’s public catalogue; not verified against their internal data.

数据来自PubChem来源: PubChem (NIH)