Skip to Content
Merck
CN
All Photos(1)

Documents

Safety Information

M66900

Sigma-Aldrich

3-Methyl-3-pentanol

98%

Synonym(s):

Diethyl methyl carbinol

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
(CH3CH2)2C(CH3)OH
CAS Number:
77-74-7
Molecular Weight:
102.17
Beilstein:
1731456
EC Number:
201-053-4
MDL number:
MFCD00004483
UNSPSC Code:
12352100
PubChem Substance ID:
24897105
NACRES:
NA.22

Assay

98%

form

liquid

refractive index

n20/D 1.418 (lit.)

bp

123 °C (lit.)

mp

−38 °C (lit.)

density

0.824 g/mL at 25 °C (lit.)

SMILES string

CCC(C)(O)CC

InChI

1S/C6H14O/c1-4-6(3,7)5-2/h7H,4-5H2,1-3H3

InChI key

FRDAATYAJDYRNW-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Warning

Hazard Statements

H226,H302

Hazard Classifications

Acute Tox. 4 Oral - Flam. Liq. 3

WGK

WGK 3

Flash Point(F)

closed cup

Flash Point(C)

closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

新产品

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Alfonso Pérez-Garrido et al.
Bioorganic & medicinal chemistry, 17(2), 896-904 (2008-12-06)
This paper reports a QSAR study for predicting the complexation of a large and heterogeneous variety of substances (233 organic compounds) with beta-cyclodextrins (beta-CDs). Several different theoretical molecular descriptors, calculated solely from the molecular structure of the compounds under investigation

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service