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928-45-0

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Basic Information
CAS No.: 928-45-0
Name: N-BUTYL NITRATE
Article Data: 38
Molecular Structure:
Molecular Structure of 928-45-0 (N-BUTYL NITRATE)
Formula: C4H9 N O3
Molecular Weight: 119.12
Synonyms: Butylnitrate (6CI,7CI); n-Butyl nitrate
Density: 1.047g/cm3
Melting Point: -111.59°C (estimate)
Boiling Point: 135.3°Cat760mmHg
Flash Point: 49.9°C
Solubility: 774.3mg/L(25 oC)
Appearance: Colourless Oil
Hazard Symbols: T,N
Risk Codes: R61; R20/22; R33; R50/53; R62
Safety: An explosive. Reacts explosively with Lewis acids (e.g., boron trifluoride; aluminum chloride; etc.). When heated to decomposition it emits toxic fumes of NOx. See also NITRATES.
PSA: 55.05000
LogP: 1.51800
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Conditions
ConditionsYield
With N-nitro-2,4,6-trimethylpyridinium tetrafluoroborate In acetonitrile at 0℃; for 2h;100%
With carbon dioxide; dinitrogen pentoxide at 0℃; under 45004.5 - 60006 Torr; for 0.5h; Autoclave;94%
With nitric acid; urea; europium(III) trifluoromethanesulfonate In cyclohexane at 80℃; for 10h; Schlenk technique;90%
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Conditions
ConditionsYield
at 250℃; under 760 Torr; for 3h;50%
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Conditions
ConditionsYield
With silver nitrate; acetonitrile
With silver nitrate In acetonitrile
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Conditions
ConditionsYield
With silver nitrate; acetonitrile
With nitric acid at -10℃;
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ethene

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Conditions
ConditionsYield
With nitric acid Electrolysis.an Platinanoden;
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sodium butanolate

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Conditions
ConditionsYield
With dichloromethane; dinitrogen tetraoxide; butan-1-ol at -80℃;

1-picryl-pyridinium; nitrate

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butan-1-ol

928-45-0

butyl nitrate

69153-16-8

butyl-nitro-amine; ammonium salt

928-45-0

butyl nitrate

Conditions
ConditionsYield
With nitrylfluoride In acetonitrile
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A

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butyl nitrate

B

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n-butoxymethyl-nitrate

Conditions
ConditionsYield
With dinitrogen pentoxide In dichloromethane at 0 - 10℃;
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n-butane

A

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B

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C

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sec-butyl nitrite

D

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2-nitrobutane

E

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2-butyl nitrate

F

627-05-4

1-nitrobutane

Conditions
ConditionsYield
With dihydrogen peroxide; Nitrogen dioxide at 24.9℃; under 300.02 Torr; Rate constant; Product distribution; Mechanism; boric-acid-coated surface; various pressure and carrier-gas composition;A 6 % Chromat.
B 0.3 % Chromat.
C 31 % Chromat.
D 51 % Chromat.
E 3 % Chromat.
F 7 % Chromat.
...Expand
Raw Materials
2568-90-3
109-73-9
7732-18-5
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109-65-9
109-52-4
71-36-3
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Downstream Products
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1126-78-9
32954-52-2
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179075-88-8
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123-72-8
88-72-2
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Chemistry

Chemistry informtion about Butyl Nitrate(CAS NO.928-45-0) is:
IUPAC Name: butyl nitrate
Synonyms: N-Butyl Nitrate ; 1-Butylnitrate ; Butylnitrate ; N-C4H9ONO2 ; Nitric Acid, Butyl Ester ; Nitricacid,Butylester ; Nitricacidbutylester ; 1-Nitrooxybutane
Molecular Weight: 119.11916 [g/mol]
Molecular Formula: C4H9NO3
XLogP3: 2.1
H-Bond Donor: 0
H-Bond Acceptor: 3
EINECS: 213-172-9 
Canonical SMILES: CCCCO[N+](=O)[O-]
InChI: InChI=1S/C4H9NO3/c1-2-3-4-8-5(6)7/h2-4H2,1H3
InChIKey: QQHZPQUHCAKSOL-UHFFFAOYSA-N
Density: 1.047 g/cm3
Flash Point: 49.9 °C
Enthalpy of Vaporization: 35.74 kJ/mol
Boiling Point: 135.3 °C at 760 mmHg
Vapour Pressure: 9.6 mmHg at 25°C
Product Categories: Alkylnitrate ; Intermediate ; Miscellaneous Reagents
Following is the molecular structure of Butyl Nitrate(CAS NO.928-45-0) is:

Uses

Despite its health risks, Butyl Nitrate(CAS NO.928-45-0) is used as an inhalant.

Safety Profile

An explosive. Reacts explosively with Lewis acids (e.g., boron trifluoride; aluminum chloride; etc.). When heated to decomposition it emits toxic fumes of NOx. See also NITRATES. 
RIDADR: 1992
HazardClass: 3.2
PackingGroup: III

Specification

Butyl Nitrate(CAS NO.928-45-0) is colourless oil with a flammable chemical compound.