2-Methylpentanedinitrile
Also known as 2-Methylglutaronitrile, Methylglutaronitrile, Diacrylonitrile
Key facts
What buyers check first
- Appearance
- Liquid at ambient temperatures
- Boiling point
- 125 to 130
- Density
- 0.95 at 68 °F - Less dense than water, will float
- Flash point
- 126.1 °C
- Solubility
- 10 to 50 mg/mL at 70.7 °F
- HS code
- 292690
- Category
- Nitriles, nitro and azo compounds
- UN number
- UN 3276

What is 2-Methylpentanedinitrile?
Plain description, key identifiers and synonyms
2-methyl-Pentanedinitrile is a nitrile.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 2-methylpentanedinitrile
- CAS number
- 4553-62-2 CAS number cross-checkedOther or deprecated CAS: 28906-50-5
- EC number
- 224-923-5
- Molecular formula
- C6H8N2
- UNII
- EJX3MSL725
- MDL number
- MFCD00001875
- InChIKey
- FPPLREPCQJZDAQ-UHFFFAOYSA-N
- InChI
- InChI=1S/C6H8N2/c1-6(5-8)3-2-4-7/h6H,2-3H2,1H3
- SMILES (canonical and isomeric)
- CC(CCC#N)C#N
Synonyms
- 2-Methylglutaronitrile
- Methylglutaronitrile
- Diacrylonitrile
- 1,3-Dicyanobutane
- Methyl glutaronitrile
- 2,4-Dicyanobutane
- Pentanedinitrile, 2-methyl-
- Glutaronitrile, 2-methyl-
- 2-Methyl-1,5-valerodinitrile
- 1,5-Valerodinitrile, 2-methyl-
- Glutanonitrile, alpha-methyl-
- MGN cpd
- alpha-Methylglutaronitrile
- alpha-Methylglutarodinitrile
- alpha-Methylglutarsaeuredinitril
- 4-02-00-01990 (Beilstein Handbook Reference)
- Methylpentanedinitrile
- Pentanedinitrile, methyl-
- 2-methyglutaronitrile
- Glutaronitrile, methyl-
- 2-Methyl glutarodinitrile
- 2-Methyl pentanedinitrile
- 2-methyl-Pentanedinitrile
- 2-Methylglutaronitrile, 99%
- MGN
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
| Appearance | Liquid at ambient temperaturesexp.Measured value |
|---|---|
| Boiling point | 125 to 130exp.Measured value |
| Density | 0.95 at 68 °F - Less dense than water, will floatexp.Measured value |
| Flash point | 126.1 °Cexp.Measured value |
| Solubility | 10 to 50 mg/mL at 70.7 °Fexp.Measured value |
| Vapour pressure | 0.0051 mm Hg at 25 °Cexp.Measured value |
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 108.14 g/molcalc.Computed value |
|---|---|
| Exact mass | 108.0687 Dacalc.Computed value |
| LogP (octanol/water) | 1.45calc.Computed value |
| Topological polar surface area | 47.58 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 2calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 8calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.67calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 1calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H301 + H311Toxic if swallowed. Toxic in contact with skin.
- H301Toxic if swallowed.
- H311Toxic in contact with skin.
- H330Fatal if inhaled.
Precautionary statements (18)
- P260Do not breathe dust, fume, gas, mist, vapours or spray.
- P262Do not get in eyes, on skin, or on clothing.
- P264Wash skin thoroughly after handling.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P284In case of inadequate ventilation wear respiratory protection.
- P301 + P316If swallowed: Get emergency medical help immediately.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P316Get emergency medical help immediately.
- P320Specific treatment is urgent (see supplemental first aid instructions on the label).
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P361 + P364Take off immediately all contaminated clothing. And wash it before reuse.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
- UN number
- UN 3276
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aid2-Methylpentanedinitrile suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- China ManufacturerUnclaimed profile2-MethylpentanedinitrileGrade, purity and minimum order on requestPrice on request
- United States, Wichita ManufacturerUnclaimed profile2-MethylpentanedinitrileGrade, purity and minimum order on requestPrice on request
- United StatesUnclaimed profile2-MethylpentanedinitrileGrade, purity and minimum order on requestPrice on request
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Where suppliers are based
3 suppliers in 2 countries
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2-Methylpentanedinitrile price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Used as a solvent and intermediate for the manufacture of other chemicals.
Industrial uses: Intermediate, Other.
Industries and functions
Regulatory status
Inventories, regulations and trade controls that list this substance
United States
- TSCA inventory (USA)Status: Active in US commerce
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code 2-Methylpentanedinitrile is traded under.
Nitrile-function compounds, other
- United States13.6%
- China12.4%
- Brazil11.9%
* Partner reported figures, a lower bound.
The HS code shown for 2-Methylpentanedinitrile is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about 2-Methylpentanedinitrile, based on the data on this page
What is 2-Methylpentanedinitrile?
What is the CAS number of 2-Methylpentanedinitrile?
What is the molecular formula and weight of 2-Methylpentanedinitrile?
What is 2-Methylpentanedinitrile used for?
Is 2-Methylpentanedinitrile hazardous?
What is the HS code of 2-Methylpentanedinitrile?
Where can I buy 2-Methylpentanedinitrile?
What is the price of 2-Methylpentanedinitrile?
Guides for buyers
Practical guides that help when you source, ship or handle 2-Methylpentanedinitrile
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, Trade and logisticsShipping dangerous goods: UN numbers, classes and packing groupsHow the UN dangerous goods system works for chemicals, from the nine classes and UN numbers to packing groups, UN packaging marks, labels, documents and segregation.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
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