3-Methylcrotononitrile

• CAS: 4786-24-7
• Catalog Number: ACM4786247
• Category: Main Products
• Molecular Weight: 81.12
• Molecular Formula: C₅H₇N
• Synonyms: 3-Methyl-2-butenenitrile; 3,3-dimethyl acrylonitrile; 3-METHYLCROTONONITRILE; 2-Butenenitrile,3-methyl; 3,3-Dimethylacrylonitril
• IUPAC Name: 3-methylbut-2-enenitrile
• Canonical SMILES: CC(=CC#N)C
• InChI Key: AUGKLUNRHYPDAM-UHFFFAOYSA-N
• Boiling Point: 123.6ºC at 760mmHg
• Flash Point: 27.6ºC
• Density: 0.828g/cm³
• EC Number: 225-336-7
• Exact Mass: 81.05780

Custom Q&A

What is the molecular formula of 3-Methylcrotononitrile?

The molecular formula of 3-Methylcrotononitrile is C5H7N.

What are the synonyms of 3-Methylcrotononitrile?

The synonyms of 3-Methylcrotononitrile are 3-methylbut-2-enenitrile and 3-Methyl-2-butenenitrile.

What is the molecular weight of 3-Methylcrotononitrile?

The molecular weight of 3-Methylcrotononitrile is 81.12 g/mol.

What is the IUPAC name of 3-Methylcrotononitrile?

The IUPAC name of 3-Methylcrotononitrile is 3-methylbut-2-enenitrile.

What is the InChI of 3-Methylcrotononitrile?

The InChI of 3-Methylcrotononitrile is InChI=1S/C5H7N/c1-5(2)3-4-6/h3H,1-2H3.

What is the InChIKey of 3-Methylcrotononitrile?

The InChIKey of 3-Methylcrotononitrile is AUGKLUNRHYPDAM-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Methylcrotononitrile?

The canonical SMILES of 3-Methylcrotononitrile is CC(=CC#N)C.

What is the CAS number of 3-Methylcrotononitrile?

The CAS number of 3-Methylcrotononitrile is 4786-24-7.

What is the European Community (EC) number of 3-Methylcrotononitrile?

The European Community (EC) number of 3-Methylcrotononitrile is 225-336-7.

What is the formal charge of 3-Methylcrotononitrile?

The formal charge of 3-Methylcrotononitrile is not mentioned in the reference.