2-Bromo-5-fluoro-4-methylbenzonitrile

CAS
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Purity
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CAS
916792-11-5
Size
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Purity
96%
Price
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Availability
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Catalog Number

ACM916792115

Product Name

2-Bromo-5-fluoro-4-methylbenzonitrile

Structure

Structure

CAS

916792-11-5

Category

Heterocyclic Organic Compound

Synonyms

2-Bromo-5-fluoro-4-methylbenzonitrile, 916792-11-5, CTK7C7323, MolPort-008-266-843, ZINC26893598, AKOS015842396, AG-C-28794, 2-Bromo-5-fluoro-4-methyl-benzonitrile, AK-36866, KB-68298, FT-0650592, A21016

IUPAC Name

2-bromo-5-fluoro-4-methylbenzonitrile

Molecular Weight

214.034403 [g/mol]

Molecular Formula

C8H5BrFN

InChI Key

BYIUSPLUNPDMFR-UHFFFAOYSA-N

Boiling Point

283.37ºC at 760 mmHg

Flash Point

125.178ºC

Density

1.596g/cm³

Exact Mass

212.95900

H-Bond Acceptor

2

H-Bond Donor

0

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 2-Bromo-5-fluoro-4-methylbenzonitrile?

The molecular formula is C8H5BrFN.

When was 2-Bromo-5-fluoro-4-methylbenzonitrile created and last modified?

It was created on May 29, 2009, and last modified on December 30, 2023.

What is the IUPAC Name of 2-Bromo-5-fluoro-4-methylbenzonitrile?

The IUPAC Name is 2-bromo-5-fluoro-4-methylbenzonitrile.

What is the InChI of 2-Bromo-5-fluoro-4-methylbenzonitrile?

The InChI is InChI=1S/C8H5BrFN/c1-5-2-7(9)6(4-11)3-8(5)10/h2-3H,1H3.

What is the molecular weight of 2-Bromo-5-fluoro-4-methylbenzonitrile?

The molecular weight is 214.03 g/mol.

How many hydrogen bond donor counts are present in 2-Bromo-5-fluoro-4-methylbenzonitrile?

There are 0 hydrogen bond donor counts.

What is the XLogP3-AA value of 2-Bromo-5-fluoro-4-methylbenzonitrile?

The XLogP3-AA value is 2.8.

What is the exact mass of 2-Bromo-5-fluoro-4-methylbenzonitrile?

The exact mass is 212.95894 g/mol.

How many topological polar surface areas are present in 2-Bromo-5-fluoro-4-methylbenzonitrile?

The topological polar surface area is 23.8 Å².

Is the compound canonicalized?

Yes, the compound is canonicalized.

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