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190586

Sigma-Aldrich

4,4-Dimethyl-2-pentanol

98%

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About This Item

Linear Formula:
(CH3)3CCH2CH(OH)CH3
CAS Number:
6144-93-0
Molecular Weight:
116.20
EC Number:
228-147-8
MDL number:
MFCD00004548
UNSPSC Code:
12352100
PubChem Substance ID:
24851446

assay

98%

refractive index

n20/D 1.418 (lit.)

bp

137-137.5 °C/736 mmHg (lit.)

density

0.815 g/mL at 25 °C (lit.)

SMILES string

CC(O)CC(C)(C)C

InChI

1S/C7H16O/c1-6(8)5-7(2,3)4/h6,8H,5H2,1-4H3

InChI key

OIBKGNPMOMMSSI-UHFFFAOYSA-N

General description

Chemical ionization mass spectra of 4,4-dimethyl-2-pentanol has been studied.

Application

4,4-Dimethyl-2-pentanol has been used in the synthesis of tertiary 2-aminoquinoline derivatives.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

98.6 °F - closed cup

flash_point_c

37 °C - closed cup

ppe

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

Certificates of Analysis (COA)

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Chemical ionization mass spectrometry. XII. Alcohols.
Field FH.
Journal of the American Chemical Society, 92(9), 2672-2676 (1970)
Andrew J Souers et al.
Bioorganic & medicinal chemistry letters, 14(19), 4873-4877 (2004-09-03)
A high-throughput screen was performed in order to identify chemotypes that are bound by the melanin concentrating hormone receptor-1 (MCHr1). A novel 2-amino-8-alkoxyquinoline compound (1) was identified and subsequently optimized using a parallel and automated procedure for the rapid production

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