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N9381

Sigma-Aldrich

3′-Nitroacetophenone

ReagentPlus®, 99%

Synonym(s):

m-nitroacetophenone

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About This Item

Linear Formula:
O2NC6H4COCH3
CAS Number:
121-89-1
Molecular Weight:
165.15
Beilstein:
743002
EC Number:
204-504-3
MDL number:
MFCD00007259
UNSPSC Code:
12352100
PubChem Substance ID:
24897897
NACRES:
NA.22

product line

ReagentPlus®

Assay

99%

form

crystals

bp

202 °C (lit.)

mp

76-78 °C (lit.)

SMILES string

CC(=O)c1cccc(c1)[N+]([O-])=O

InChI

1S/C8H7NO3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3

InChI key

ARKIFHPFTHVKDT-UHFFFAOYSA-N

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General description

The nitro and carbonyl oxygen atoms of 3′-nitroacetophenone can act as hydrogen-bond acceptors.

Application

3′-Nitroacetophenone can undergo high hydrostatic pressure-assisted reduction with Ni–Al alloy in water to form 1-(3-aminophenyl)ethanol.

Legal Information

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany

Hazard Statements

H412

Precautionary Statements

P273 - P501

Hazard Classifications

Aquatic Chronic 3

Storage Class Code

11 - Combustible Solids

WGK

WGK 2

Flash Point(F)

376.9 °F - closed cup

Flash Point(C)

191.6 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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’.

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3-Nitroacetophenone
Feeder N
Acta Crystallographica Section C, Crystal Structure Communications, 52(6), 1454-1456 (1996)
Selective reduction of ketones using water as a hydrogen source under high hydrostatic pressure.
Tomin A
Organic & Biomolecular Chemistry, 10(36), 7321-7326 (2012)

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