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Sigma-Aldrich

1-Nitrohexane

98%

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

Quality Level

100

Assay

98%

refractive index

n20/D 1.423 (lit.)

bp

91-92 °C/24 mmHg (lit.)

density

0.94 g/mL at 25 °C (lit.)

SMILES string

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

InChI

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

InChI key

FEYJIFXFOHFGCC-UHFFFAOYSA-N

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General description

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

Application

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

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

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

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

163.4 °F

Flash Point(C)

73 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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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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