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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

Signal Word

Warning

Hazard Statements

H226,H315,H319,H335

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

98.6 °F - closed cup

Flash Point(C)

37 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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.

FSL

Group 4: Flammable liquids
Type 2 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

190586-1G:
190586-5G:
190586-VAR:
190586-BULK:

Certificates of Analysis (COA)

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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
Chemical ionization mass spectrometry. XII. Alcohols.
Field FH.
Journal of the American Chemical Society, 92(9), 2672-2676 (1970)

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