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Cas Database

Name	2-Nitropropene	EINECS	N/A
CAS No.	4749-28-4	Density	1.015g/cm³
PSA	45.82000	LogP	1.31990
Solubility	N/A	Melting Point	65-67 °C
Formula	C3H5 N O2	Boiling Point	119.4°Cat760mmHg
Molecular Weight	87.0782	Flash Point	31.9°C
Transport Information	N/A	Appearance	N/A
Safety	Potentially dangerous polymerization reaction on contact with alkalies. When heated to decomposition it emits toxic fumes of NO_x. See also NITROALKANES.	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Propene,2-nitro- (6CI,7CI,8CI); 2-Nitro-1-propene; 2-Nitropropene; 2-Nitropropylene	Article Data	31

2-Nitropropene Synthetic route

: 2902-96-7
2-NITROPROPANOL

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
With phthalic anhydride Heating;	94%
With phthalic anhydride at 150 - 185℃; for 1.5h;	72%
With triethylamine; trifluoroacetic anhydride Inert atmosphere;	56%

: 609-31-4
2-nitro-1-butanol

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
With phthalic anhydride at 150 - 200℃;	52%

: 3275-15-8
1-(2-nitro-propyl)-piperidine

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
With diethyl ether; Di(2-ethylhexyl)phthalate; boron trifluoride anschliessendes Erhitzen unter 1 Torr auf 105grad;

: 2425-66-3
1-chloro-2-nitro-propane

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
With silica gel at 325℃;

: 3750-82-1
2-nitroacetoxypropane

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
With sodium carbonate; benzene

: 5437-73-0
benzoic acid-(2-nitro-propyl ester)

A: 4749-28-4
2-nitropropene

B: 65-85-0
benzoic acid

Conditions

Conditions	Yield
auch unter vermindertem Druck;

N-<2-nitro-propyl>-piperidine hydrochloride: N-<2-nitro-propyl>-piperidine hydrochloride

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
at 105 - 160℃; under 70 Torr;

: 3750-82-1
2-nitroacetoxypropane

calcium magnesium phosphate: calcium magnesium phosphate

A: 4749-28-4
2-nitropropene

B: 64-19-7
acetic acid

Conditions

Conditions	Yield
at 285℃;

: 187737-37-7
propene

A: 4749-28-4
2-nitropropene

B: 123-38-6
propionaldehyde

C: 67-64-1
acetone

Conditions

Conditions	Yield
With bis(acetonitrile)chloronitropalladium(II) In chloroform at 25℃; under 0.1 Torr; for 6h; Product distribution; Further Variations:; Reagents;	A 6 % Chromat. B 1 % Chromat. C 93 % Chromat.

: 102588-22-7
N,N-bis(trimethylsilyloxy)-1-propen-2-amine

: 4749-28-4
2-nitropropene

Conditions

Conditions	Yield
With bromine; tetrabutylammonium acetate In dichloromethane at -78 - 20℃;	95 % Spectr.

2-Nitropropene Chemical Properties

Product Name: 2-Nitropropene (CAS NO.4749-28-4)

IUPAC: 2-Nitroprop-1-ene
Molecular Formula: C₃H₅NO₂
Molecular Weight: 87.08g/mol
Mol File: 4749-28-4.mol
Boiling point: 119.4 °C at 760 mmHg
Flash Point: 31.9 °C
Density: 1.015 g/cm³
Surface Tension: 26.9 dyne/cm
Enthalpy of Vaporization: 34.28 kJ/mol
Vapour Pressure: 19.1 mmHg at 25°C
XLogP3-AA: 1.1
H-Bond Donor: 0
H-Bond Acceptor: 2

2-Nitropropene Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LCLo	inhalation	250mg/m³/10M (250mg/m³)		National Defense Research Committee, Office of Scientific Research and Development, Progress Report.Vol. No.9-4-1-19, Pg. 1943,

2-Nitropropene Safety Profile

Potentially dangerous polymerization reaction on contact with alkalies. When heated to decomposition it emits toxic fumes of NO_x. See also NITROALKANES.

2-Nitropropene Specification

2-Nitropropene , its CAS NO. is 4749-28-4, the synonyms are 2-Nitropropylene ; 4-01-00-00764 (Beilstein Handbook Reference) ; BRN 1209319 ; TL 1147 ; Propene, 2-nitro- .

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