2-Methylglutaronitrile , >98.0%(GC) , 4553-62-2

CAS NO.：4553-62-2

Empirical Formula: C6H8N2

Molecular Weight: 108.14

MDL number: MFCD00001875

EINECS: 224-923-5

PRODUCT Properties

• Melting point: −45 °C (−49 °F; 228 K)
• Boiling point: 263 °C (505 °F; 536 K)
• Density: 0.9548 g/cm3
• vapor pressure: 1.9Pa at 20℃
• refractive index: 1.43
• Flash point: 115 °C
• storage temp.: Store at +2°C to +8°C.
• solubility: water: soluble
• form: liquid
• color: colorless
• explosive limit: 0.3-3.25%(V)
• Water Solubility: 52.3g/L at 20℃
• BRN: 1741955
• Henry's Law Constant: 3.3×10² mol/(m³Pa) at 25℃, HSDB (2015)
• InChI: 1S/C6H8N2/c1-6(5-8)3-2-4-7/h6H,2-3H2,1H3
• InChIKey: FPPLREPCQJZDAQ-UHFFFAOYSA-N
• SMILES: CC(CCC#N)C#N
• LogP: 0.46 at 20℃
• CAS DataBase Reference: 4553-62-2(CAS DataBase Reference)
• EPA Substance Registry System: 2-Methylglutaronitrile (4553-62-2)

Description and Uses

2-Methylglutaronitrile (MGN) may be used in the synthesis of 1,5-dimethyl-2-piperidone (1,5-DMPD) by chemoenzymatic process.

Safety

• Symbol(GHS): GHS06
• Signal word: Danger
• Hazard statements: H301+H311-H330
• Precautionary statements: P280-P301+P310+P330-P302+P352+P312-P304+P340+P310
• PPE: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
• Hazard Codes: Xn,T
• Risk Statements: 20/21/22-23/25-21
• Safety Statements: 36/37-45-36/37/39
• RIDADR: 3276
• WGK Germany: 3
• RTECS: YV8140000
• TSCA: TSCA listed
• HS Code: 2926.90.5050
• HazardClass: 6.1(b)
• PackingGroup: III
• Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2; very toxic hazardous materials
• Hazard Classifications: Acute Tox. 2 Inhalation; Acute Tox. 3 Dermal; Acute Tox. 3 Oral
• Hazardous Substances Data: 4553-62-2(Hazardous Substances Data)
• REACH Registrations: Active