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Merck
CN

259497

1-Nitrohexane

98%

Synonym(s):

1-Nitrohexane

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About This Item

Linear Formula:
CH3(CH2)5NO2
CAS Number:
646-14-0
Molecular Weight:
131.17
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24855709
EC Number:
211-467-7
Beilstein/REAXYS Number:
1749466
MDL number:
MFCD00007411

Key Documents

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Product Name

1-Nitrohexane, 98%

assay

98%

InChI key

FEYJIFXFOHFGCC-UHFFFAOYSA-N

InChI

1S/C6H13NO2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3

SMILES string

CCCCCC[N+]([O-])=O

refractive index

n20/D 1.423 (lit.)

bp

91-92 °C/24 mmHg (lit.)

density

0.94 g/mL at 25 °C (lit.)

functional group

amine
nitro

Quality Level

100

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Application

1-Nitrohexane has been used in preparation of silyl nitronates.

General description

The electroreduction of 1-nitrohexane in the absence and presence of n-octanol and n-decanol has been studied.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

163.4 °F - closed cup

flash_point_c

73 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
BCBM2479V
BCBM2478V
1450975V
047941/1
1450975

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Anomalous Influence of Adsorbed Higher Aliphatic Alcohols on Electroreduction of Nitromethane and 1-Nitrohexane on Mercury Electrodes.
Gromulska A, et al.
Electroanalysis, 11(9), 595-600 (1999)
Silyl nitronates: improved nitro-aldol reactions and reductive routes to 2-aminoalcohols.
Colvin EW and Seebach D.
Journal of the Chemical Society. Chemical Communications, 16, 689-691 (1978)

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The Carbon Enigma: Material Fundamentals and Retention Properties for Porous Graphitic Carbon (PGC) Stationary Phases

A shortened review of fundamentals of Porous Graphitic Carbon (PGC) materials. What they are and how do they work as a stationary phase material in HPLC?.

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