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424749

Sigma-Aldrich

trans-β-Methyl-β-nitrostyrene

99%

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About This Item

Linear Formula:
C6H5CH=C(CH3)NO2
CAS Number:
Molecular Weight:
163.17
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

99%

form

solid

mp

63-65 °C (lit.)

functional group

amine
nitro
phenyl

storage temp.

2-8°C

SMILES string

[H]\C(=C(\C)[N+]([O-])=O)c1ccccc1

InChI

1S/C9H9NO2/c1-8(10(11)12)7-9-5-3-2-4-6-9/h2-7H,1H3/b8-7+

InChI key

WGSVFWFSJDAYBM-BQYQJAHWSA-N

General description

trans-β-Methyl-β-nitrostyrene (1-phenyl-2-nitropropene), a nitrostyrene derivative is an α,β-disubstituted nitroalkene. It has been synthesized by reacting benzaldehyde with nitroethane and butylamine. Spectroscopic analysis of 1-phenyl-2-nitropropene has been done using FT-IR, FT-Raman, NMR and UV.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Acute Tox. 4 Oral

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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