2-[(3-Bromo-4-methoxyphenyl)methylidene]propanedinitrile
2-[(3-bromo-4-methoxyphenyl)methylidene]propanedinitrile
Also Known As: 2-[(3-bromo-4-methoxyphenyl)methylidene]propanedinitrile|2-(3-Bromo-4-methoxybenzylidene)malononitrile|RARECHEM AL BX 0247|KS-000028XH|MS-7044|(3-BROMO-4-METHOXYBENZYLIDENE)MALONONITRILE|(3-bromo-4-methoxybenzylidene)propanedinitrile|J2.953.040H|2-[(3-bromo-4-methoxyphenyl)methylene]malononitrile|[(3-Bromo-4-methoxyphenyl)methylidene]propanedinitrile|2-[(3-bromo-4-methoxy-phenyl)methylene]propanedinitrile|((3-BROMO-4-METHOXYPHENYL)METHYLENE)METHANE-1,1-DICARBONITRILE
| Molecular Formula | C11H7BrN2O |
|---|---|
| Molecular Weight | 261.97418 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.97418 |
| Monoisotopic Mass | 261.97418 |
| Heavy Atoms | 15 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 313670-97-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=C(C#N)C#N)Br |
| InChIKey | MYCUMQDZUIOCTJ-UHFFFAOYSA-N |
Product Overview
2-[(3-Bromo-4-methoxyphenyl)methylidene]propanedinitrile (CAS 313670-97-2), with molecular formula C11H7BrN2O and molecular weight 261.97418 g/mol. IUPAC: 2-[(3-bromo-4-methoxyphenyl)methylidene]propanedinitrile.