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3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE

CAS No.
115955-48-1
Chemical Name:
3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE
Synonyms
3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE;2-Propen-1-one, 3-(dimethylamino)-1-(3-nitrophenyl)-;(2E)-3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one
CBNumber:
CB4729934
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.22
MDL Number:
MFCD00024513
MOL File:
Mol file
MSDS File:
SDS
Last updated:2025-07-24 18:13:42
Product description Number Pack Size Price
3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one D495110 100mg $110
3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 130871 1g $84
(2E)-3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one FD137190 250mg $85
3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one OR110306 1g $108
3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 4956-1-25 1g $128
More product size

3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE Properties

Melting point 109-111 °C
Boiling point 341.4±42.0 °C(Predicted)
Density 1.202±0.06 g/cm3(Predicted)
storage temp. 2-8°C
pka 6.24±0.70(Predicted)
Appearance Light brown to brown Solid

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H302+H312+H332-H315-H319
Precautionary statements  P501-P261-P270-P271-P264-P280-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330-P302+P352+P312-P304+P340+P312
HazardClass  IRRITANT
HS Code  2922390090

3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
TRC D495110 3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 115955-48-1 100mg $110 2021-12-16 Buy
Matrix Scientific 130871 3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 115955-48-1 1g $84 2021-12-16 Buy
Biosynth Carbosynth FD137190 (2E)-3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 115955-48-1 250mg $85 2021-12-16 Buy
Apolloscientific OR110306 3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 115955-48-1 1g $108 2021-12-16 Buy
SynQuest Laboratories 4956-1-25 3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 115955-48-1 1g $128 2021-12-16 Buy
Product number Packaging Price Buy
D495110 100mg $110 Buy
130871 1g $84 Buy
FD137190 250mg $85 Buy
OR110306 1g $108 Buy
4956-1-25 1g $128 Buy

3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE Chemical Properties,Uses,Production

Synthesis

N,N-Dimethylformamide dimethyl acetal

4637-24-5

3-Nitroacetophenone

121-89-1

3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE

115955-48-1

To a 250 mL round bottom flask was added 16.5 g (100 mmol) of m-nitroacetophenone, 26.5 mL of N,N-dimethylformamide dimethyl acetal (200 mmol) and 100 mL of xylene. The reaction mixture was heated to 140 °C and kept for 12 hours. After completion of the reaction, the mixture was cooled to room temperature and the precipitate was collected by filtration. The precipitate was washed sequentially with petroleum ether and ethyl ether, and then purified by silica gel column chromatography (eluent: ethyl acetate/cyclohexane, 25/75, v/v) to afford 19.6 g of the yellow solid product, 3-(dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one, in 89% yield. The structure of the product was determined by 1H NMR (200 MHz, DMSO-d6) δ 8.59 (t, 1H), 8.42-8.23 (m, 1H), 7.81 (d, J = 12.1 Hz, 1H), 7.70 (t, J = 7.9 Hz, 1H), 5.89 (d, J = 12.1 Hz, 1H), 3.17 (s, 1H), 2.95 (s , 1H) and confirmed by 13C NMR (50 MHz, DMSO-d6) δ 182.8, 155.2, 147.9, 141.6, 133.4, 129.8, 125.1, 121.5, 90.3, 44.7, 37.3.

References

[1] Bioorganic and Medicinal Chemistry Letters, 2017, vol. 27, # 8, p. 1780 - 1783
[2] Patent: US2007/219183, 2007, A1. Location in patent: Page/Page column 11
[3] Bioorganic and Medicinal Chemistry Letters, 2009, vol. 19, # 10, p. 2735 - 2738
[4] Bioorganic and Medicinal Chemistry Letters, 2009, vol. 19, # 24, p. 6890 - 6892
[5] Patent: US2006/63784, 2006, A1. Location in patent: Page/Page column 43

3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE Preparation Products And Raw materials

Raw materials

Preparation Products

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3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE Spectrum

3-(DIMETHYLAMINO)-1-(3-NITROPHENYL)-2-PROPEN-1-ONE (2E)-3-(Dimethylamino)-1-(3-nitrophenyl)prop-2-en-1-one 2-Propen-1-one, 3-(dimethylamino)-1-(3-nitrophenyl)- 115955-48-1