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75607

Trimethyl orthovalerate

Name: Trimethyl orthovalerate
Brand: SIAL

purum, ≥97.0% (GC)

Synonym(s):

1,1,1-Trimethoxypentane

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About This Item

Linear Formula:

CH₃CH₂CH₂CH₂C(OCH₃)₃

CAS Number:

13820-09-2

Molecular Weight:

162.23

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

329766163

EC Number:

237-496-5

Beilstein/REAXYS Number:

1739200

MDL number:

MFCD00008481

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Properties

grade

purum

assay

≥97.0% (GC)

form

liquid

refractive index

n20/D 1.410

bp

164-166 °C (lit.)

density

0.941 g/mL at 25 °C (lit.)

SMILES string

CCCCC(OC)(OC)OC

InChI

1S/C8H18O3/c1-5-6-7-8(9-2,10-3)11-4/h5-7H2,1-4H3

InChI key

XUXVVQKJULMMKX-UHFFFAOYSA-N

Description

Application

Trimethyl orthovalerate is used in the synthesis of 1,2,4-triazolo[1,5-c]pyrimidine derivatives as human adenosine A₃ receptor ligands. It can also be used as a precursor to prepare N-sulfonyl and N-sulfinyl imines and imidates.

pictograms

GHS02,GHS07

signalword

Warning

hcodes

H226,H315,H319

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

107.6 °F - closed cup

flash_point_c

42 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

pcodes

P210 - P233 - P240 - P241 - P303 + P361 + P353 - P305 + P351 + P338

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