Structure

3,4-Dimethoxyphenethyl bromide

CAS
40173-90-8
Catalog Number
ACM40173908
Category
Ethers
Molecular Weight
245.11
Molecular Formula
C10H12O4

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Specification

Hazard Statements
H302
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of 3,4-Dimethoxyphenethyl bromide?

The molecular formula of 3,4-Dimethoxyphenethyl bromide is C10H13BrO2.

What is the molecular weight of 3,4-Dimethoxyphenethyl bromide?

The molecular weight of 3,4-Dimethoxyphenethyl bromide is 245.11 g/mol.

What is the IUPAC name of 3,4-Dimethoxyphenethyl bromide?

The IUPAC name of 3,4-Dimethoxyphenethyl bromide is 4-(2-bromoethyl)-1,2-dimethoxybenzene.

What is the InChI (International Chemical Identifier) of 3,4-Dimethoxyphenethyl bromide?

The InChI of 3,4-Dimethoxyphenethyl bromide is InChI=1S/C10H13BrO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5-6H2,1-2H3.

What is the InChIKey of 3,4-Dimethoxyphenethyl bromide?

The InChIKey of 3,4-Dimethoxyphenethyl bromide is LTAGXVMHLFYRNK-UHFFFAOYSA-N.

What is the canonical SMILES (Simplified Molecular Input Line Entry System) of 3,4-Dimethoxyphenethyl bromide?

The canonical SMILES of 3,4-Dimethoxyphenethyl bromide is COC1=C(C=C(C=C1)CCBr)OC.

What is the CAS (Chemical Abstracts Service) number of 3,4-Dimethoxyphenethyl bromide?

The CAS number of 3,4-Dimethoxyphenethyl bromide is 40173-90-8.

What is the European Community (EC) number of 3,4-Dimethoxyphenethyl bromide?

The European Community (EC) number of 3,4-Dimethoxyphenethyl bromide is 627-728-7.

What is the XLogP3 value of 3,4-Dimethoxyphenethyl bromide?

The XLogP3 value of 3,4-Dimethoxyphenethyl bromide is 2.5.

Is 3,4-Dimethoxyphenethyl bromide a canonicalized compound?

Yes, 3,4-Dimethoxyphenethyl bromide is a canonicalized compound.

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