3-METHYLPHENETHYL BROMIDE

• CAS: 16799-08-9
• Catalog Number: ACM16799089
• Category: Other Products; Alkyl
• Molecular Weight: 199.09
• Molecular Formula: C9H11Br
• Synonyms: Toluene, m-(2-bromoethyl)-, 1-(2-Bromoethyl)-3-methylbenzene, 3-methylphenethyl bromide, 1-(2-bromo-ethyl)-3-methyl-benzene, 16799-08-9, 1-Bromo-2-m-tolylethane, AC1LC74J, AC1Q27TH, SureCN1520881, CTK4D2835, AR-1L6966, AKOS011898143, Benzene,1-(2-bromoethyl)-3-methyl-, AG-A-12195, AG-K-90477, Benzene, 1-(2-bromoethyl)-3-methyl-, KB-146443, KB-212856, Toluene,m-(2-bromoethyl)- (6CI,7CI,8CI); 1-(2-Bromoethyl)-3-methylbenzene;1-Bromo-2-m-tolylethane; 2-[3-Methylphenyl]ethyl bromide; 3-Methylphenethylbromide; m-Methylphenethyl bromide
• IUPAC Name: 1-(2-bromoethyl)-3-methylbenzene
• Canonical SMILES: CC1=CC(=CC=C1)CCBr
• InChI Key: STQJFINZGUXVEX-UHFFFAOYSA-N
• Boiling Point: 101-103ºC/11 mmHg
• Flash Point: 94.3ºC
• Density: 1.307 g/mL at 25ºC
• Exact Mass: 198.00400
• Hazard Statements: Xn: Harmful;N: Dangerous for the environment
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• RIDADR: UN 3082 9 / PGIII
• Safety Description: S26
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 3-Methylphenethyl bromide?

The molecular formula of 3-Methylphenethyl bromide is C9H11Br.

What is the molecular weight of 3-Methylphenethyl bromide?

The molecular weight of 3-Methylphenethyl bromide is 199.09 g/mol.

What is the IUPAC name of 3-Methylphenethyl bromide?

The IUPAC name of 3-Methylphenethyl bromide is 1-(2-bromoethyl)-3-methylbenzene.

What is the InChI of 3-Methylphenethyl bromide?

The InChI of 3-Methylphenethyl bromide is InChI=1S/C9H11Br/c1-8-3-2-4-9(7-8)5-6-10/h2-4,7H,5-6H2,1H3.

What is the InChIKey of 3-Methylphenethyl bromide?

The InChIKey of 3-Methylphenethyl bromide is STQJFINZGUXVEX-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Methylphenethyl bromide?

The canonical SMILES of 3-Methylphenethyl bromide is CC1=CC(=CC=C1)CCBr.

What is the CAS number of 3-Methylphenethyl bromide?

The CAS number of 3-Methylphenethyl bromide is 16799-08-9.

What is the European Community (EC) Number of 3-Methylphenethyl bromide?

The European Community (EC) Number of 3-Methylphenethyl bromide is 628-031-0.

What is the DSSTox Substance ID of 3-Methylphenethyl bromide?

The DSSTox Substance ID of 3-Methylphenethyl bromide is DTXSID50341157.

Is 3-Methylphenethyl bromide a canonicalized compound?

Yes, 3-Methylphenethyl bromide is a canonicalized compound.