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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 - closed cup

flash_point_c

80 °C - closed cup

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.

Substances Subject to be Indicated Names

ishl_indicated

Substances Subject to be Notified Names

ishl_notified

Group 4: Flammable liquids + Type 3 petroleums + Hazardous rank III + Water insoluble liquid

fsl

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