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Structure

3-(4-Bromophenyl)propanenitrile

CAS
57775-08-3
Catalog Number
ACM57775083
Category
Bromine Series
Molecular Weight
210.07
Molecular Formula
C9H8BrN

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What is the molecular formula of 3-(4-Bromophenyl)propanenitrile?

The molecular formula is C9H8BrN.

What is the molecular weight of 3-(4-Bromophenyl)propanenitrile?

The molecular weight is 210.07 g/mol.

What is the IUPAC name of 3-(4-Bromophenyl)propanenitrile?

The IUPAC name is 3-(4-bromophenyl)propanenitrile.

What is the InChI of 3-(4-Bromophenyl)propanenitrile?

The InChI is InChI=1S/C9H8BrN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H,1-2H2.

What is the InChIKey of 3-(4-Bromophenyl)propanenitrile?

The InChIKey is QAWLKTDBUQOFEF-UHFFFAOYSA-N.

What is the canonical SMILES of 3-(4-Bromophenyl)propanenitrile?

The canonical SMILES is C1=CC(=CC=C1CCC#N)Br.

What is the CAS number of 3-(4-Bromophenyl)propanenitrile?

The CAS number is 57775-08-3.

What is the European Community (EC) number of 3-(4-Bromophenyl)propanenitrile?

The European Community (EC) number is 673-011-7.

What is the DSSTox Substance ID of 3-(4-Bromophenyl)propanenitrile?

The DSSTox Substance ID is DTXSID60370832.

Is 3-(4-Bromophenyl)propanenitrile a canonicalized compound?

Yes, 3-(4-Bromophenyl)propanenitrile is canonicalized according to PubChem.

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