![1-[2,3-Diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene structure](/static/products/4464/4464-33-9.webp)
1-[2,3-Diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene
1-[2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene
Also Known As: Xanthocillin X dimethyl ether|Xanthocillin dimethyl ether|Xanthocillin X permethyl ether|Ethylene isocyanide, bis(p-methoxybenzylidene)-|Bis(p-methoxybenzylidene)ethylene isocyanide|Benzene, 1,1'-(2,3-diisocyano-1,3-butadiene-1,4-diyl)bis(4-methoxy-|Benzene, 1,1'-(2,3-diisocyano-1,3-butadiene-1,4-diyl)bis(4-methoxy- (9CI)
CAS: 4464-33-9
| Molecular Formula | C20H16N2O2 |
|---|---|
| Molecular Weight | 316.1212 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 27.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.1212 |
| Monoisotopic Mass | 316.1212 |
| Heavy Atoms | 24 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 4464-33-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=C(C(=CC2=CC=C(C=C2)OC)[N+]#[C-])[N+]#[C-] |
| InChIKey | VJKZMXOJMQCHRI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (1 patents)
Pharmaceutical Intermediates (1 patents)
Product Overview
1-[2,3-Diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene (CAS 4464-33-9), with molecular formula C20H16N2O2 and molecular weight 316.1212 g/mol. IUPAC: 1-[2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
Frequently Asked Questions
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