2 5-Bis(octyloxy)terephthalaldehyde98

• CAS: 123440-34-6
• Catalog Number: ACM123440346
• Category: Organic & Printed Electronics
• Molecular Weight: 390.55612
• Molecular Formula: C₂₄H₃₈O₄
• Synonyms: 2 5-BIS(OCTYLOXY)TEREPHTHALALDEHYDE98;2,5-BIS(OCTYLOXY)TEREPHTHALADEHYDE, 98%;2,5-Bis(octyloxy)terephthalaldehyde 98%
• IUPAC Name: 2,5-dioctoxyterephthalaldehyde
• Canonical SMILES: CCCCCCCCOC1=CC(=C(C=C1C=O)OCCCCCCCC)C=O
• InChI Key: HBPJKNOOUOGSOG-UHFFFAOYSA-N
• Melting Point: 76-79ºC(lit.)
• Exact Mass: 390.27700
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Safety Description: 26-36

Custom Q&A

What is the molecular formula of 2,5-Bis(octyloxy)terephthalaldehyde?

The molecular formula is C24H38O4.

When was 2,5-Bis(octyloxy)terephthalaldehyde first created in the database?

It was first created on September 12, 2005.

What is the computed IUPAC name of 2,5-Bis(octyloxy)terephthalaldehyde?

The computed IUPAC name is 2,5-dioctoxyterephthalaldehyde.

What is the InChIKey of 2,5-Bis(octyloxy)terephthalaldehyde?

The InChIKey is HBPJKNOOUOGSOG-UHFFFAOYSA-N.

What is the canonical SMILES representation of 2,5-Bis(octyloxy)terephthalaldehyde?

The canonical SMILES is CCCCCCCCOC1=CC(=C(C=C1C=O)OCCCCCCCC)C=O.

What is the molecular weight of 2,5-Bis(octyloxy)terephthalaldehyde?

The molecular weight is 390.6 g/mol.

How many hydrogen bond acceptor counts does 2,5-Bis(octyloxy)terephthalaldehyde have?

It has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 2,5-Bis(octyloxy)terephthalaldehyde?

The topological polar surface area is 52.6Ų.

Is 2,5-Bis(octyloxy)terephthalaldehyde a canonicalized compound?

Yes, it is a canonicalized compound.

How many rotatable bond counts does 2,5-Bis(octyloxy)terephthalaldehyde have?

It has 18 rotatable bond counts.