8-Bromoquinoline-3-carboxylic acid

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Product Information

Molecular Formula
n1cc(cc2cccc(c12)Br)C(=O)O
Molecular Weight
252.07
Description
Applications: 8-bromoquinoline-3-carboxylic acid is a useful research chemical.
Synonyms
8-Bromo-3-carboxyquinoline
IUPAC Name
8-bromoquinoline-3-carboxylic acid
SMILES
C1=CC2=CC(=CN=C2C(=C1)Br)C(=O)O
InChI
InChI=1S/C10H6BrNO2/c11-8-3-1-2-6-4-7(10(13)14)5-12-9(6)8/h1-5H,(H,13,14)
InChI Key
QMAXUQVGYIBBKN-UHFFFAOYSA-N
Purity
95%

Computed Properties

XLogP3
2.4
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
250.95819 g/mol
Monoisotopic Mass
250.95819 g/mol
Topological Polar Surface Area
50.2Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
234
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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