3,4-Dichloro-N-(prop-2-yn-1-yl)benzamide

• Catalog Number: ACMA00000812
• Category: Amines
• Molecular Weight: 228.07
• Molecular Formula: C₁₀H₁₆ClNO₂
• Hazard Statements: H302-H319
• RIDADR: UN 2811 6.1 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound?

The molecular formula of the compound is C10H7Cl2NO.

What are the synonyms of the compound?

The synonyms of the compound are AKOS008955875 and Z52403994.

What is the molecular weight of the compound?

The molecular weight of the compound is 228.07 g/mol.

When was the compound created and modified?

The compound was created on May 28, 2009, and last modified on December 2, 2023.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 3,4-dichloro-N-prop-2-ynylbenzamide.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C10H7Cl2NO/c1-2-5-13-10(14)7-3-4-8(11)9(12)6-7/h1,3-4,6H,5H2,(H,13,14).

What is the InChIKey of the compound?

The InChIKey of the compound is IKMHTYZERACRNK-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is C#CCNC(=O)C1=CC(=C(C=C1)Cl)Cl.

What is the XLogP3 value of the compound?

The XLogP3 value of the compound is 3.3.

What is the hydrogen bond donor count of the compound?

The hydrogen bond donor count of the compound is 1.