2-(4-Bromophenyl)butanoic acid

• CAS: 99070-18-5
• Catalog Number: ACM99070185
• Category: Other Products
• Molecular Weight: 243.1
• Molecular Formula: O=C(C(c1ccc(cc1)Br)CC)O
• Synonyms: (4-Bromophenyl)(ethyl)acetic acid
• IUPAC Name: 2-(4-bromophenyl)butanoic acid
• Canonical SMILES: CCC(C1=CC=C(C=C1)Br)C(=O)O
• InChI Key: XVEFRABIRRNWFO-UHFFFAOYSA-N
• Boiling Point: 342.1ºC at 760 mmHg
• Flash Point: 160.7ºC
• Density: 1.457g/cm³
• Exact Mass: 241.99400
• Hazard Statements: Xi
• H-Bond Acceptor: 2
• H-Bond Donor: 1

Custom Q&A

What is the molecular formula of 2-(4-Bromophenyl)butanoic acid?

The molecular formula is C10H11BrO2.

What is the molecular weight of 2-(4-Bromophenyl)butanoic acid?

The molecular weight is 243.10 g/mol.

What is the IUPAC name of 2-(4-Bromophenyl)butanoic acid?

The IUPAC name is 2-(4-bromophenyl)butanoic acid.

What is the InChI key of 2-(4-Bromophenyl)butanoic acid?

The InChI key is XVEFRABIRRNWFO-UHFFFAOYSA-N.

What is the canonical SMILES of 2-(4-Bromophenyl)butanoic acid?

The canonical SMILES is CCC(C1=CC=C(C=C1)Br)C(=O)O.

What is the CAS number of 2-(4-Bromophenyl)butanoic acid?

The CAS number is 99070-18-5.

What is the European Community (EC) number of 2-(4-Bromophenyl)butanoic acid?

The European Community (EC) number is 869-924-7.

What is the XLogP3-AA value of 2-(4-Bromophenyl)butanoic acid?

The XLogP3-AA value is 3.

How many hydrogen bond donor counts does 2-(4-Bromophenyl)butanoic acid have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-(4-Bromophenyl)butanoic acid have?

It has 2 hydrogen bond acceptor counts.