4-BroMo-4'-Methylbiphenyl

• CAS: 844856-52-6
• Catalog Number: ACM844856526
• Category: Bromine Series
• Molecular Weight: 247.13
• Molecular Formula: C13H11Br
• Synonyms: 1-Bromo-3-(4-methylphenyl)benzene
• IUPAC Name: 1-bromo-3-(4-methylphenyl)benzene
• Canonical SMILES: CC1=CC=C(C=C1)C2=CC(=CC=C2)Br
• InChI: InChI=1S/C13H11Br/c1-10-5-7-11(8-6-10)12-3-2-4-13(14)9-12/h2-9H,1H3
• InChI Key: ZAZDXCNAQVUYEE-UHFFFAOYSA-N
• Boiling Point: 313.7±11.0 ºC
• Melting Point: 42.9-43.2 ºC
• Density: 1.320±0.06 g/ml
• Exact Mass: 246.00400
• H-Bond Acceptor: 0
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of 4-Bromo-4'-methylbiphenyl?

The molecular formula of 4-Bromo-4'-methylbiphenyl is C13H11Br.

What is the molecular weight of 4-Bromo-4'-methylbiphenyl?

The molecular weight of 4-Bromo-4'-methylbiphenyl is 247.13 g/mol.

What is the IUPAC name of 4-Bromo-4'-methylbiphenyl?

The IUPAC name of 4-Bromo-4'-methylbiphenyl is 1-bromo-4-(4-methylphenyl)benzene.

What is the InChI of 4-Bromo-4'-methylbiphenyl?

The InChI of 4-Bromo-4'-methylbiphenyl is InChI=1S/C13H11Br/c1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12/h2-9H,1H3.

What is the InChIKey of 4-Bromo-4'-methylbiphenyl?

The InChIKey of 4-Bromo-4'-methylbiphenyl is MYWLXURJCXISCT-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Bromo-4'-methylbiphenyl?

The Canonical SMILES of 4-Bromo-4'-methylbiphenyl is CC1=CC=C(C=C1)C2=CC=C(C=C2)Br.

What is the CAS number of 4-Bromo-4'-methylbiphenyl?

The CAS number of 4-Bromo-4'-methylbiphenyl is 50670-49-0.

What is the EC number of 4-Bromo-4'-methylbiphenyl?

The EC number of 4-Bromo-4'-methylbiphenyl is 806-631-5.

What is the DSSTox Substance ID of 4-Bromo-4'-methylbiphenyl?

The DSSTox Substance ID of 4-Bromo-4'-methylbiphenyl is DTXSID10334601.

Is 4-Bromo-4'-methylbiphenyl a canonicalized compound?

Yes, 4-Bromo-4'-methylbiphenyl is a canonicalized compound.