2-Bromo-4'-methylacetophenone

CAS

619-41-0

Catalog Number

ACM619410

Category

Bromine Series

Molecular Weight

213.07

Molecular Formula

C9H9BrO

MSDS COA Spec Sheet

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Specification

Synonyms

2-Bromo-4-methylacetophenone, NCIOpen2_002710, 159530_ALDRICH, Acetophenone, 2-bromo-4-methyl-, TOS-BB-1114, 2-Bromo-1-(4-methylphenyl)ethanone, Ethanone, 2-bromo-1-(4-methylphenyl)-, NSC63192, EINECS 210-595-0, Halomethyl Phenyl Ketone deriv. 26, ZINC00159088, ST5211494, TL8003986, 619-41-0, InChI=1/C9H9BrO/c1-7-2-4-8(5-3-7)9(11)6-10/h2-5H,6H2,1H

IUPAC Name

2-bromo-1-(4-methylphenyl)ethanone

Canonical SMILES

CC1=CC=C(C=C1)C(=O)CBr

InChI Key

KRVGXFREOJHJAX-UHFFFAOYSA-N

Boiling Point

105ºC(0.1 torr)

Melting Point

52-53ºC

Flash Point

74.4ºC

Density

1.416 g/cm³

Appearance

White to light yellow crystal powder

EC Number

210-595-0

Exact Mass

211.98400

Hazard Statements

Xi:Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

S26-S37/39

Stability

Stable. Incompatible with strong oxidizing agents, strong bases.

WGK Germany

What is the molecular formula of 2-Bromo-4'-methylacetophenone?

The molecular formula of 2-Bromo-4'-methylacetophenone is C9H9BrO.

What is the molecular weight of 2-Bromo-4'-methylacetophenone?

The molecular weight of 2-Bromo-4'-methylacetophenone is 213.07 g/mol.

What is the IUPAC name of 2-Bromo-4'-methylacetophenone?

The IUPAC name of 2-Bromo-4'-methylacetophenone is 2-bromo-1-(4-methylphenyl)ethanone.

What is the InChI of 2-Bromo-4'-methylacetophenone?

The InChI of 2-Bromo-4'-methylacetophenone is InChI=1S/C9H9BrO/c1-7-2-4-8(5-3-7)9(11)6-10/h2-5H,6H2,1H3.

What is the InChIKey of 2-Bromo-4'-methylacetophenone?

The InChIKey of 2-Bromo-4'-methylacetophenone is KRVGXFREOJHJAX-UHFFFAOYSA-N.

What is the Canonical SMILES of 2-Bromo-4'-methylacetophenone?

The Canonical SMILES of 2-Bromo-4'-methylacetophenone is CC1=CC=C(C=C1)C(=O)CBr.

What is the CAS number of 2-Bromo-4'-methylacetophenone?

The CAS number of 2-Bromo-4'-methylacetophenone is 619-41-0.

What is the European Community (EC) number of 2-Bromo-4'-methylacetophenone?

The European Community (EC) number of 2-Bromo-4'-methylacetophenone is 210-595-0.

What is the density of 2-Bromo-4'-methylacetophenone?

The reference does not provide information about the density of 2-Bromo-4'-methylacetophenone.

Is 2-Bromo-4'-methylacetophenone a canonicalized compound?

Yes, 2-Bromo-4'-methylacetophenone is a canonicalized compound.