8.01336
Pivalic acid
for synthesis
Synonym(s):
Pivalic acid, Neopentanoic acid, 2,2-Dimethylpropionic acid, Trimethylacetic acid
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About This Item
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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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2
Storage Class
11 - Combustible Solids
wgk
WGK 1
flash_point_f
147.2 °F - closed cup
flash_point_c
64 °C - closed cup
Regulatory Listings
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Designated Flammable Substances + Flammable solid + +
fsl
Substances Subject to be Indicated Names
ishl_indicated
Substances Subject to be Notified Names
ishl_notified
Certificates of Analysis (COA)
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 8.01336.0100 | 04022536366272 |
| 8.01336.1000 | 04022536366289 |