2,3-Dibenzyl-1,3-butadiene

• Catalog Number: ACM62640748
• Product Name: 2,3-Dibenzyl-1,3-butadiene
• CAS: 62640-74-8
• Category: Heterocyclic Organic Compound
• Synonyms: 2,3-Dibenzyl-1,3-butadiene, 62640-74-8, ACMC-1BAGG, AC1MSFN5, 392413_ALDRICH, CTK5B5433, AKOS015889004, (3-benzyl-2-methylidenebut-3-enyl)benzene, I01-17439
• IUPAC Name: (3-benzyl-2-methylidenebut-3-enyl)benzene
• Molecular Weight: 234.34
• Molecular Formula: [C₆H₅CH₂C(=CH₂)-]2
• Canonical SMILES: C=C(CC1=CC=CC=C1)C(=C)CC2=CC=CC=C2
• InChI Key: FNCJMHZWHWRYEO-UHFFFAOYSA-N
• Boiling Point: 359.3ºC at 760 mmHg
• Melting Point: 86-88ºC (dec.)(lit.)
• Flash Point: 184ºC
• Density: 0.981g/cm³
• Exact Mass: 234.14100
• Hazard Statements: Xn
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• RIDADR: NONH for all modes of transport
• Safety Description: 22-26-36
• Symbol: GHS09

Custom Q&A

What is the molecular formula of 2,3-Dibenzyl-1,3-butadiene?

The molecular formula is C18H18.

What is the molecular weight of 2,3-Dibenzyl-1,3-butadiene?

The molecular weight is 234.3 g/mol.

What is the IUPAC name of 2,3-Dibenzyl-1,3-butadiene?

The IUPAC name is (3-benzyl-2-methylidenebut-3-enyl)benzene.

What is the InChI of 2,3-Dibenzyl-1,3-butadiene?

The InChI is InChI=1S/C18H18/c1-15(13-17-9-5-3-6-10-17)16(2)14-18-11-7-4-8-12-18/h3-12H,1-2,13-14H2.

What is the InChIKey of 2,3-Dibenzyl-1,3-butadiene?

The InChIKey is FNCJMHZWHWRYEO-UHFFFAOYSA-N.

What is the canonical SMILES of 2,3-Dibenzyl-1,3-butadiene?

The canonical SMILES is C=C(CC1=CC=CC=C1)C(=C)CC2=CC=CC=C2.

What is the CAS number of 2,3-Dibenzyl-1,3-butadiene?

The CAS number is 62640-74-8.

What is the European Community (EC) number of 2,3-Dibenzyl-1,3-butadiene?

The European Community (EC) number is 622-944-8.

What is the DSSTox Substance ID of 2,3-Dibenzyl-1,3-butadiene?

The DSSTox Substance ID is DTXSID50393398.

Is 2,3-Dibenzyl-1,3-butadiene a canonicalized compound?

Yes, it is a canonicalized compound.