7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester

CAS

948290-16-2

Catalog Number

ACM948290162

Category

Other Products

Molecular Weight

294.14

Molecular Formula

C₁₃H₁₂BrNO₂

MSDS COA Spec Sheet

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Specification

Synonyms

7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester;Ethyl 7-bromo-2-methylquinoline-3-carboxylate

IUPAC Name

ethyl 7-bromo-2-methylquinoline-3-carboxylate

Canonical SMILES

CCOC(=O)C1=C(N=C2C=C(C=CC2=C1)Br)C

InChI Key

PYRVSBADHBVVGL-UHFFFAOYSA-N

Boiling Point

358.5ºC at 760 mmHg

Flash Point

170.6ºC

Density

1.444g/cm³

Exact Mass

293.00500

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The molecular formula of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is C13H12BrNO2.

What is the molecular weight of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The molecular weight of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is 294.14 g/mol.

What is the IUPAC name of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The IUPAC name of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is ethyl 7-bromo-2-methylquinoline-3-carboxylate.

What is the InChI of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The InChI of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is InChI=1S/C13H12BrNO2/c1-3-17-13(16)11-6-9-4-5-10(14)7-12(9)15-8(11)2/h4-7H,3H2,1-2H3.

What is the InChIKey of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The InChIKey of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is PYRVSBADHBVVGL-UHFFFAOYSA-N.

What is the Canonical SMILES of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The Canonical SMILES of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is CCOC(=O)C1=C(N=C2C=C(C=CC2=C1)Br)C.

What is the CAS number of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The CAS number of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is 948290-16-2.

What is the European Community (EC) Number of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester?

The European Community (EC) Number of 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is 804-519-0.

How many hydrogen bond acceptor counts does 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester have?

7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester has 3 hydrogen bond acceptor counts.

Is 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester a canonicalized compound?

Yes, 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester is a canonicalized compound.