4-Methylvaleric acid

ALDRICH/277827 - 99%

Synonym: 4-Methylpentanoic acid; Isocaproic acid

CAS Number: 646-07-1
Empirical Formula (Hill Notation): C₆H₁₂O₂
Molecular Weight: 116.16
EC Number: 211-464-0
MDL Number: MFCD00002803
Linear Formula: (CH₃)₂CHCH₂CH₂CO₂H
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-277827-5G	5 g	$30.20 1/EA		Add To Favorites
45-277827-25G	25 g	$103.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	99%
bp	199-201 °C (lit.)
density	0.923 g/mL at 25 °C (lit.)
form	liquid
InChI	1S/C6H12O2/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChI key	FGKJLKRYENPLQH-UHFFFAOYSA-N
Quality Level	100
refractive index	n20/D 1.414 (lit.)
SMILES string	CC(C)CCC(O)=O

Application:	4-Methylvaleric acid has been used in asymmetric synthesis of (4S)-4-isopropyl-3-[(2′S)-2′,4′-dimethyl-valeryl)]-2-oxazolidinone.
General description:	Conductimetric detection of 4-methylvaleric acid on unfunctionized polymethacrylate resin (TSKgel G3000PWXL) columns has been reported.
Packaging:	5, 25 g in glass bottle

Symbol	GHS05,GHS06
Signal word	Danger
Hazard statements	H311 - H314
Precautionary statements	P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P361 + P364 - P405
Hazard Codes	Xn
Risk Statements	21-38
Safety Statements	36/37
RIDADR	UN 2810 6.1 / PGIII
WGK Germany	WGK 3
Flash Point(F)	206.6 °F - closed cup
Flash Point(C)	97 °C - closed cup

Purity	99%
bp	199-201 °C (lit.)
Density	0.923 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.414 (lit.)
UNSPSC	12352100

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