ChemicalBook--->CAS DataBase List--->5500-21-0

5500-21-0

5500-21-0 Structure

5500-21-0 Structure
IdentificationMore
[Name]

Cyclopropanecarbonitrile
[CAS]

5500-21-0
[Synonyms]

CYANOCYCLOPROPANE
CYCLOPROPANECARBONITRILE
CYCLOPROPANE CYANIDE
CYCLOPROPYL CYANIDE
CYCLOPROPYLNITRILE
Cyclopropanecarboxylic acid nitrile
Cyclopropanenitrile
Cyclopropanecarbonitrile,98%
Cyclopropanecarboxynitrile
Cyclopropanecarbonitrile 98%
Cyclopropancarbonitril
CPCN
Cyanocyclopropane, Cyclopropyl cyanide
[EINECS(EC#)]

226-836-8
[Molecular Formula]

C4H5N
[MDL Number]

MFCD00001269
[Molecular Weight]

67.09
[MOL File]

5500-21-0.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to faintly yellow liquid
[Boiling point ]

135 °C (lit.)
[density ]

0.911 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.421(lit.)
[Fp ]

91 °F
[storage temp. ]

Flammables area
[solubility ]

Chloroform, Methanol (Slightly)
[form ]

Liquid
[color ]

Clear colorless to faintly yellow
[Specific Gravity]

0.905
[Water Solubility ]

Miscible with water.
[BRN ]

635790
[Exposure limits]

NIOSH: IDLH 25 mg/m3
[InChI]

1S/C4H5N/c5-3-4-1-2-4/h4H,1-2H2
[InChIKey]

AUQDITHEDVOTCU-UHFFFAOYSA-N
[SMILES]

N#CC1CC1
[CAS DataBase Reference]

5500-21-0(CAS DataBase Reference)
[NIST Chemistry Reference]

Cyclopropanecarbonitrile(5500-21-0)
[EPA Substance Registry System]

5500-21-0(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T,F
[Risk Statements ]

R10:Flammable.
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S16:Keep away from sources of ignition-No smoking .
S7/9:Keep container tightly closed and in a well-ventilated place .
[RIDADR ]

UN 3275 6.1/PG 2
[WGK Germany ]

2
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29269095
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Cyclopropyl isocyanide-->4-BROMOBUTYRONITRILE-->G-IODOBUTYRONITRILE-->CYCLOPROPANECARBOXAMIDE-->Aminomethylcyclopropane-->4-Chlorobutyronitrile
[Preparation Products]

Cyclopropane-1-carboximidamide hydrochloride-->Cyclopropyl phenyl ketone-->4-HYDROXY-BUTYRONITRILE-->3-CYCLOPROPYL-3-OXO-PROPIONIC ACID ETHYL ESTER-->Cyclopropyl 2-fluorobenzyl ketone-->Cyclopropyl 4-fluorophenyl ketone-->CYCLOPROPANECARBOTHIOAMIDE-->3-CHLOROPHENYL CYCLOPROPYL KETONE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Cyclopropyl cyanide(5500-21-0).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to faintly yellow liquid
[Uses]

Cyclopropanecarbonitrile is a cyano substituted cycloalkane. Cyclopropanecarbonitrile is an Impurity of pazufloxacin mesylate (P211000).
[Application]

Cyclopropane formonitrile is a nitrile compound with cyclopropane structural units, which has important applications in organic synthesis, especially in the fields of medicine and pesticides. It can be used to prepare cis- and trans-crotonium nitrile, as well as allyl cyanide. It can also react with Grignard reagents such as magnesium phenyl bromide.
[Synthesis]

There are many methods for synthesizing cyclopropaneformitrile. A common industrial synthetic route uses 4-chlorobutyronitrile as a starting material and carries out an intramolecular cyclization reaction under alkaline conditions (such as sodium hydroxide (NaOH)) to generate a cyclopropane ring.
Spectrum DetailBack Directory
[Spectrum Detail]

Cyclopropanecarbonitrile(5500-21-0)1HNMR
Cyclopropanecarbonitrile(5500-21-0)IR
Cyclopropanecarbonitrile(5500-21-0)Raman
Cyclopropanecarbonitrile(5500-21-0)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Cyclopropyl cyanide, 98%(5500-21-0)
[Alfa Aesar]

Cyclopropanecarbonitrile, 98%(5500-21-0)
[Sigma Aldrich]

5500-21-0(sigmaaldrich)
[TCI AMERICA]

Cyclopropyl Cyanide,>97.0%(GC)(5500-21-0)
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