4-Amino-6-methoxyquinoline-3-carboxylic acid

CAS

933710-66-8

Catalog Number

ACM933710668

Category

Other Products

Molecular Weight

218.208700 [g/mol]

Molecular Formula

C11H10N2O3

MSDS COA Spec Sheet

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Specification

Synonyms

4-amino-6-methoxyquinoline-3-carboxylic acid, 933710-66-8, SureCN436681, AGN-PC-013RYB, STOCK1N-71869, MolPort-005-306-778, SBB018963, STK694435, ZINC12296443, AKOS002332247, MCULE-3532640765, KB-240154, ST4145795, BB 0221873, 4-Amino-6-methoxy-quinoline-3-carboxylic acid

IUPAC Name

4-amino-6-methoxyquinoline-3-carboxylic acid

Canonical SMILES

COC1=CC2=C(C(=CN=C2C=C1)C(=O)O)N

InChI Key

GCQXPAGPGGXAAD-UHFFFAOYSA-N

Boiling Point

441.8ºC at 760 mmHg

Flash Point

221ºC

Density

1.402g/cm³

Exact Mass

218.06900

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 4-Amino-6-methoxyquinoline-3-carboxylic acid?

The molecular formula of 4-Amino-6-methoxyquinoline-3-carboxylic acid is C11H10N2O3.

When was 4-Amino-6-methoxyquinoline-3-carboxylic acid first created in PubChem?

4-Amino-6-methoxyquinoline-3-carboxylic acid was first created in PubChem on July 31, 2007.

What is the molecular weight of 4-Amino-6-methoxyquinoline-3-carboxylic acid?

The molecular weight of 4-Amino-6-methoxyquinoline-3-carboxylic acid is 218.21 g/mol.

What is the Canonical SMILES representation of 4-Amino-6-methoxyquinoline-3-carboxylic acid?

The Canonical SMILES representation of 4-Amino-6-methoxyquinoline-3-carboxylic acid is COC1=CC2=C(C(=CN=C2C=C1)C(=O)O)N.

What is the InChIKey of 4-Amino-6-methoxyquinoline-3-carboxylic acid?

The InChIKey of 4-Amino-6-methoxyquinoline-3-carboxylic acid is GCQXPAGPGGXAAD-UHFFFAOYSA-N.

How many Hydrogen Bond Donor Count does 4-Amino-6-methoxyquinoline-3-carboxylic acid have?

4-Amino-6-methoxyquinoline-3-carboxylic acid has 2 Hydrogen Bond Donor Count.

What is the XLogP3-AA value of 4-Amino-6-methoxyquinoline-3-carboxylic acid?

The XLogP3-AA value of 4-Amino-6-methoxyquinoline-3-carboxylic acid is 1.6.

How many Rotatable Bond Count does 4-Amino-6-methoxyquinoline-3-carboxylic acid have?

4-Amino-6-methoxyquinoline-3-carboxylic acid has 2 Rotatable Bond Count.

What is the Topological Polar Surface Area of 4-Amino-6-methoxyquinoline-3-carboxylic acid?

The Topological Polar Surface Area of 4-Amino-6-methoxyquinoline-3-carboxylic acid is 85.4Å².

Is 4-Amino-6-methoxyquinoline-3-carboxylic acid considered a Canonicalized compound in PubChem?

Yes, 4-Amino-6-methoxyquinoline-3-carboxylic acid is considered a Canonicalized compound in PubChem.