4-Iodobiphenyl

• CAS: 1591-31-7
• Catalog Number: ACM1591317-1
• Category: Aryl
• Molecular Weight: 280.11
• Molecular Formula: C12H9I
• Synonyms: p-Iodobiphenyl,4-Iododiphenyl,p-Phenyliodobenzene,4-Biphenyliodide,4-IODOBIPHENYL,Biphenyl,4-iodo-,1,1-Biphenyl,4-iodo-,4-Iodo-1,1-biphenyl,Biphenyl,4-iodo-(8CI),637769_ALDRICH,NSC3791,CID15322,NSC3791,EINECS216-469-1,STK325713,ZINC00980089,AI3-15372,TL8001204,AE-848/30708050,1591-31-7
• IUPAC Name: 1-iodo-4-phenylbenzene
• SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)I
• InChI: InChI=1S/C12H9I/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
• InChI Key: NXYICUMSYKIABQ-UHFFFAOYSA-N
• Boiling Point: 112 °C
• Melting Point: 322.7 °C at 760mmHg
• Flash Point: 145.8ºC
• Density: 1.584 g/ml
• Appearance: White to light yellow powder to crystal
• EC Number: 216-469-1
• Exact Mass: 279.97500
• Hazard Statements: H410 : Very toxic to aquatic life with long lasting effects.
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• MDL Number: MFCD00019028
• Packing Group: III
• Precautionary Statements: P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.P391 : Collect spillage.
• RIDADR: UN 3077 9 / PGIII
• Safety Description: S26-S37/39
• Signal Word: Warning
• Stability: Stable at normal temperatures and pressures.
• Symbol: GHS05
• WGK Germany: 3

Custom Q&A

What is the molecular formula of 4-Iodobiphenyl?

The molecular formula of 4-Iodobiphenyl is C12H9I.

What is the molecular weight of 4-Iodobiphenyl?

The molecular weight of 4-Iodobiphenyl is 280.10 g/mol.

What is the IUPAC name of 4-Iodobiphenyl?

The IUPAC name of 4-Iodobiphenyl is 1-iodo-4-phenylbenzene.

What is the InChI of 4-Iodobiphenyl?

The InChI of 4-Iodobiphenyl is InChI=1S/C12H9I/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H.

What is the InChIKey of 4-Iodobiphenyl?

The InChIKey of 4-Iodobiphenyl is NXYICUMSYKIABQ-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Iodobiphenyl?

The canonical SMILES of 4-Iodobiphenyl is C1=CC=C(C=C1)C2=CC=C(C=C2)I.

What is the CAS number of 4-Iodobiphenyl?

The CAS number of 4-Iodobiphenyl is 1591-31-7.

What is the XLogP3 value of 4-Iodobiphenyl?

The XLogP3 value of 4-Iodobiphenyl is 4.9.

How many hydrogen bond donor counts does 4-Iodobiphenyl have?

4-Iodobiphenyl does not have any hydrogen bond donor count.

How many hydrogen bond acceptor counts does 4-Iodobiphenyl have?

4-Iodobiphenyl does not have any hydrogen bond acceptor count.