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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:
705-60-2
Molecular Weight:
163.17
MDL number:
MFCD00014720
UNSPSC Code:
12352100
PubChem Substance ID:
24866587
NACRES:
NA.22

Quality Level

100

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

Related Categories

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
GHS07

Signal Word

Warning

Hazard Statements

H302

Precautionary Statements

P264 - P270 - P301 + P312 - P501

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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

JAN Code

424749-VAR:
424749-5G:
424749-BULK:
424749-25G:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCQ4411
MKCK7763
MKCK5204
MKCG7590
MKCG0386

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trans-β-Methylstyrene 99%

Sigma-Aldrich

111848

trans-β-Methylstyrene

Indole ≥99%

Sigma-Aldrich

I3408

Indole

A Mori et al.
Chemical & pharmaceutical bulletin, 38(12), 3449-3451 (1990-12-01)
Microbial reduction of 1-phenyl-2-nitro-1-propene (3) was carried out using 57 strains of yeast, 40 strains of aerobic and facultatively anaerobic bacteria and 40 strains of strictly anaerobic bacteria. Nine strains of yeast (Candida tropicalis, etc.,) had the ability to reduce
Gas chromatographic and mass spectral analysis of amphetamine products synthesized from 1-phenyl-2-nitropropene.
DeRuiter J, et al.
Journal of Chromatographic Science, 32(11), 511-519 (1994)
Diego Romano et al.
Microbial cell factories, 13, 60-60 (2014-04-29)
Old Yellow Enzymes (OYEs) are flavin-dependent enoate reductases (EC 1.6.99.1) that catalyze the stereoselective hydrogenation of electron-poor alkenes. Their ability to generate up to two stereocenters by the trans-hydrogenation of the C = C double bond is highly demanded in asymmetric synthesis.
Organocatalytic diastereo- and enantioselective sulfa-Michael addition to α,β-disubstituted nitroalkenes
Pei QL, et al.
Tetrahedron, 69, 5367-5373 (2013)
Tundo P and Andraos J
Green Syntheses, 119-119 (2014)
View All Related Papers

Global Trade Item Number

SKUGTIN
424749-25G
424749-5G4061832103792

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