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8.14993

3-Methylbutyl isovalerate

Name: 3-Methylbutyl isovalerate
Brand: MM

for synthesis

Synonym(s):

3-Methylbutyl isovalerate, Isopentyl isopentanoate, Isoamyl isovalerate

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About This Item

Empirical Formula (Hill Notation):

C₁₀H₂₀O₂

CAS Number:

659-70-1

Molecular Weight:

172.26

UNSPSC Code:

12352108

EC Index Number:

211-536-1

NACRES:

NA.22

MDL number:

MFCD00048369

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Properties

vapor pressure

0.8 hPa ( 20 °C)

Quality Segment

200

potency

>5000 mg/kg LD₅₀, oral (Rat), >5000 mg/kg LD₅₀, skin (Rabbit)

bp

195 °C/1013 hPa

transition temp

flash point 80 °C

solubility

0.016 g/L

density

0.855 g/cm³ at 25 °C

storage temp.

2-30°C

SMILES string

O(CCC(C)C)C(=O)CC(C)C

InChI

1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3

InChI key

XINCECQTMHSORG-UHFFFAOYSA-N

Description

Analysis Note

Assay isomers (GC, area%): ≥ 99.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.852 - 0.857
Identity (IR): passes test

Hazard Classifications

Aquatic Chronic 2

Storage Class

10 - Combustible liquids

wgk

WGK 2

flash_point_f

176.0 °F

flash_point_c

80 °C

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

Flammable liquids + Type 3 petroleums + Hazardous rank III + Water insoluble liquid

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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