3-Bromodiphenyl ether

• CAS: 6876-00-2
• Catalog Number: ACM6876002
• Category: Ethers
• Molecular Weight: 249.10
• Molecular Formula: C₁₃H₂₁NO
• Synonyms: 1-Bromo-3-phenoxybenzene, Benzene, 1-bromo-3-phenoxy-, NSC57095, CID96165, ZINC00261811, OR13134, LS-29212, EU-0066933, 6876-00-2
• IUPAC Name: 1-bromo-3-phenoxybenzene
• InChI Key: AHDAKFFMKLQPTD-UHFFFAOYSA-N
• Boiling Point: 301.3ºC at 760 mmHg
• Flash Point: 119ºC
• Density: 1.413g/cm³
• Exact Mass: 247.98400
• Hazard Statements: H319
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• RIDADR: UN 3082 9 / PGIII
• Symbol: GHS07

Custom Q&A

What is the PubChem CID of 3-Bromodiphenyl ether?

PubChem CID 96165

What is the molecular formula of 3-Bromodiphenyl ether?

The molecular formula is C12H9BrO.

What are the synonyms of 3-Bromodiphenyl ether?

The synonyms include 1-Bromo-3-phenoxybenzene, 6876-00-2, 3-Phenoxybromobenzene, and Benzene, 1-bromo-3-phenoxy-.

What is the molecular weight of 3-Bromodiphenyl ether?

The molecular weight is 249.10 g/mol.

What is the IUPAC name of 3-Bromodiphenyl ether?

The IUPAC name is 1-bromo-3-phenoxybenzene.

What is the InChI of 3-Bromodiphenyl ether?

The InChI is InChI=1S/C12H9BrO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9H.

What is the InChIKey of 3-Bromodiphenyl ether?

The InChIKey is AHDAKFFMKLQPTD-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Bromodiphenyl ether?

The canonical SMILES is C1=CC=C(C=C1)OC2=CC(=CC=C2)Br.

What is the CAS number of 3-Bromodiphenyl ether?

The CAS number is 6876-00-2.

Is 3-Bromodiphenyl ether a canonicalized compound?

Yes, 3-Bromodiphenyl ether is canonicalized according to PubChem.