Dimethyl 2-isocyanatoterephthalate

• Catalog Number: ACMA00002208
• Category: Ethers
• Molecular Weight: 235.19
• Molecular Formula: C₁₂H₁₂O₂
• Hazard Statements: H315-H319-H335
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of dimethyl 2-isocyanatoterephthalate?

The molecular formula is C11H9NO5.

What are the synonyms for dimethyl 2-isocyanatoterephthalate?

The synonyms are dimethyl 2-isocyanatoterephthalate, dimethyl 2-isocyanatobenzene-1,4-dicarboxylate, and 1,4-dimethyl 2-isocyanatobenzene-1,4-dicarboxylate.

What is the molecular weight of dimethyl 2-isocyanatoterephthalate?

The molecular weight is 235.19 g/mol.

What is the IUPAC name of dimethyl 2-isocyanatoterephthalate?

The IUPAC name is dimethyl 2-isocyanatobenzene-1,4-dicarboxylate.

What is the InChI of dimethyl 2-isocyanatoterephthalate?

The InChI is InChI=1S/C11H9NO5/c1-16-10(14)7-3-4-8(11(15)17-2)9(5-7)12-6-13/h3-5H,1-2H3.

What is the InChIKey of dimethyl 2-isocyanatoterephthalate?

The InChIKey is VLBOVVSWDHUHJK-UHFFFAOYSA-N.

What is the canonical SMILES of dimethyl 2-isocyanatoterephthalate?

The canonical SMILES is COC(=O)C1=CC(=C(C=C1)C(=O)OC)N=C=O.

What is the XLogP3-AA value of dimethyl 2-isocyanatoterephthalate?

The XLogP3-AA value is 2.4.

How many hydrogen bond donor counts does dimethyl 2-isocyanatoterephthalate have?

It has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does dimethyl 2-isocyanatoterephthalate have?

It has 6 hydrogen bond acceptor counts.