8.01336
Pivalic acid
for synthesis
别名:
Pivalic acid, Neopentanoic acid, 2,2-Dimethylpropionic acid, Trimethylacetic acid
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关于此项目
线性分子式:
(CH3)3CCOOH
化学文摘社编号:
分子量:
102.13
UNSPSC Code:
12352106
EC Index Number:
200-922-5
NACRES:
NA.22
MDL number:
Form:
crystals
vapor pressure
0.85 hPa ( 20 °C)
Quality Segment
form
crystals
potency
900 mg/kg LD50, oral (Rat), 1900 mg/kg LD50, skin (Rat)
expl. lim.
1.6 % (v/v)
mp
32-35 °C
transition temp
flash point 64 °C
solubility
25 g/L
density
0.91 g/cm3 at 20 °C
storage temp.
2-30°C
SMILES string
OC(=O)C(C)(C)C
InChI
1S/C5H10O2/c1-5(2,3)4(6)7/h1-3H3,(H,6,7)
InChI key
IUGYQRQAERSCNH-UHFFFAOYSA-N
Application
- Regiodivergent synthesis involving pivalic acid: A ligand-controlled regiodivergent C-H alkenylation process using pivalic acid, advancing the synthesis of complex indazoles and potentially impacting pharmaceutical compound development (Kim et al., 2017).
- Pivalic acid in radiochemical syntheses: The study utilized pivalic acid derivatives for the synthesis of novel radioiodinated pharmaceuticals for hypoxia imaging, highlighting its utility in diagnostic and therapeutic applications in the medical field (Elsaidi et al., 2019).
- Capillary electrophoretic applications of pivalic acid: Research explored new methods of cationic electrophoretic focusing using pivalic acid for high-sensitivity analysis of water contaminants, providing insights into environmental monitoring techniques (Malá and Gebauer, 2022).
- Cyclative coupling using pivalic acid: Zhuang et al. described a novel cyclative C-H/C-H coupling technique facilitated by pivalic acid, which rapidly constructs complex molecular frameworks like tetralin and chromane, useful in drug discovery and development (Zhuang et al., 2021).
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警示词
Warning
危险代码
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2
存储类别
11 - Combustible Solids
怎么回事？
WGK 1
闪点 (F)
147.2 °F - closed cup
闪点 (°C)
64 °C - closed cup