ChemicalBook--->CAS DataBase List--->592-31-4

592-31-4

592-31-4 Structure

592-31-4 Structure
IdentificationMore
[Name]

N-Butylurea
[CAS]

592-31-4
[Synonyms]

BUTYLUREA
N-BUTYLUREA
1-Butylurea
butyl-ure
monobutylurea
NCI-C02131
N-n-Butylurea
urea,N-butyl-
N-BUTYLUREA 99%
n-Butylurea,96%
UREA,BUTYL-
[EINECS(EC#)]

209-748-4
[Molecular Formula]

C5H12N2O
[MDL Number]

MFCD00007956
[Molecular Weight]

116.16
[MOL File]

592-31-4.mol
Chemical PropertiesBack Directory
[Appearance]

WHITE TO ALMOST WHITE CRYSTALLINE POWDER
[Melting point ]

95-98 °C (lit.)
[Boiling point ]

217.23°C (rough estimate)
[density ]

1.0551 (rough estimate)
[refractive index ]

1.4432 (estimate)
[storage temp. ]

Refrigerator
[solubility ]

Methanol
[form ]

Solid
[pka]

14.38±0.46(Predicted)
[color ]

White
[Water Solubility ]

soluble
[BRN ]

1744775
[InChI]

1S/C5H12N2O/c1-2-3-4-7-5(6)8/h2-4H2,1H3,(H3,6,7,8)
[InChIKey]

CNWSQCLBDWYLAN-UHFFFAOYSA-N
[SMILES]

CCCCNC(N)=O
[CAS DataBase Reference]

592-31-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Urea, butyl-(592-31-4)
[EPA Substance Registry System]

592-31-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
R68:Possible risk of irreversible effects.
R37:Irritating to the respiratory system.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
[WGK Germany ]

3
[RTECS ]

YS3675000
[TSCA ]

Yes
[HS Code ]

29241990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
[Safety Profile]

Moderately toxic by parenteral route. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
[Hazardous Substances Data]

592-31-4(Hazardous Substances Data)
Hazard InformationBack Directory
[General Description]

Odorless white solid.
[Reactivity Profile]

N-BUTYLUREA(592-31-4) is an amide. Amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx). This compound decomposes on heating.
[Air & Water Reactions]

Water soluble.
[Health Hazard]

ACUTE/CHRONIC HAZARDS: This compound emits toxic fumes when heated to decomposition.
[Fire Hazard]

Flash point data for this chemical are not available. N-BUTYLUREA is probably combustible.
[Chemical Properties]

WHITE TO ALMOST WHITE CRYSTALLINE POWDER
[Uses]

n-Butylurea is used as a fertilizer for rice. It is used in the preparation of drugs which are recommended for diabetes.
[Purification Methods]

Crystallise the urea from pKEst EtOH/water, then dry it under vacuum at room temperature. [Beilstein 4 I 371, 4 IV 578.]
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

N-Butylurea(592-31-4).msds
Spectrum DetailBack Directory
[Spectrum Detail]

N-Butylurea(592-31-4)MS
N-Butylurea(592-31-4)1HNMR
N-Butylurea(592-31-4)IR1
N-Butylurea(592-31-4)IR2
N-Butylurea(592-31-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

n-Butylurea, 96%(592-31-4)
[Sigma Aldrich]

592-31-4(sigmaaldrich)
[TCI AMERICA]

Butylurea,>96.0%(T)(592-31-4)
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