Isovaleric Acid

CAS
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Purity
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CAS
503-74-2
Size
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Purity
99%+
Price
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Availability
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Catalog Number

ACM503742

Product Name

Isovaleric Acid

Structure

CAS

503-74-2

Category

Heterocyclic Organic Compound

Synonyms

3-Methylbutyrate

IUPAC Name

3-Methylbutanoic acid

Molecular Weight

102.13

Molecular Formula

C5H10O2

Canonical SMILES

CC(C)CC(=O)O

InChI

InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)

InChI Key

GWYFCOCPABKNJV-UHFFFAOYSA-N

Boiling Point

175-177 °C(lit.)

Melting Point

-29 °C(lit.)

Flash Point

159 °F

Density

0.925 g/mL at 20 °C(lit.)

Solubility

soluble in alcohol, ether, water

Appearance

Liquid

Storage

Store below +30 °C

Assay

0.99

Complexity

66.5

Exact Mass

102.068079557

Monoisotopic Mass

102.068079557

Packaging

1 ton

Physical State

Liquid

pKa

4.77(at 25 °C)

Refractive Index

n20/D 1.403(lit.)

Storage Conditions

Below +30 °C

Topological Polar Surface Area

37.3 Å²

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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