4-Bromo-2-indanone

• CAS: 846032-36-8
• Catalog Number: ACM846032368
• Category: Bromine Series
• Molecular Weight: 211.05528
• Molecular Formula: C9H7BrO
• Synonyms: 4-Bromo-2,3-dihydro-1H-inden-2-one;4-Bromo-2-indanone
• IUPAC Name: 4-bromo-1,3-dihydroinden-2-one
• Canonical SMILES: C1C(=O)CC2=C1C=CC=C2Br
• InChI Key: SWTMVUZONAQICS-UHFFFAOYSA-N
• Boiling Point: 312.2ºC at 760 mmHg
• Flash Point: 126.3ºC
• Density: 1.608g/cm³
• Exact Mass: 209.96800
• H-Bond Acceptor: 1
• H-Bond Donor: 0

Custom Q&A

What is the PubChem CID of 4-Bromo-2-indanone?

The PubChem CID of 4-Bromo-2-indanone is 21073393.

What is the molecular formula of 4-Bromo-2-indanone?

The molecular formula of 4-Bromo-2-indanone is C9H7BrO.

What is the molecular weight of 4-Bromo-2-indanone?

The molecular weight of 4-Bromo-2-indanone is 211.05 g/mol.

What is the IUPAC name of 4-Bromo-2-indanone?

The IUPAC name of 4-Bromo-2-indanone is 4-bromo-1,3-dihydroinden-2-one.

What is the InChIKey of 4-Bromo-2-indanone?

The InChIKey of 4-Bromo-2-indanone is SWTMVUZONAQICS-UHFFFAOYSA-N.

How many hydrogen bond acceptors does 4-Bromo-2-indanone have?

4-Bromo-2-indanone has 1 hydrogen bond acceptor.

What is the XLogP3-AA value of 4-Bromo-2-indanone?

The XLogP3-AA value of 4-Bromo-2-indanone is 2.

Does 4-Bromo-2-indanone have any defined bond stereocenter count?

No, 4-Bromo-2-indanone does not have any defined bond stereocenter count.

What is the topological polar surface area of 4-Bromo-2-indanone?

The topological polar surface area of 4-Bromo-2-indanone is 17.1Ų.

Is 4-Bromo-2-indanone a canonicalized compound?

Yes, 4-Bromo-2-indanone is a canonicalized compound according to PubChem.