CAS 1002535-21-8 3-(1H-Pyrazol-4-yl)benzoic acid

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3-(1H-Pyrazol-4-yl)benzoic acid

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Catalog Number

ACM1002535218-3

CAS Number

1002535-21-8

Product Name

3-(1H-Pyrazol-4-yl)benzoic acid

Structure

Category

Carboxylic acid nitrogen-containing mixed MOF ligand-binary mixed ligand

Synonyms

Benzoicacid,3-(1H-pyrazol-4-yl)-

IUPAC Name

3-(1H-pyrazol-4-yl)benzoic acid

Molecular Weight

188.18

Molecular Formula

C10H8N2O2

InChI

InChI=1S/C10H8N2O2/c13-10(14)8-3-1-2-7(4-8)9-5-11-12-6-9/h1-6H,(H,11,12)(H,13,14)

InChI Key

BXSUQWZHUHROLP-UHFFFAOYSA-N

Purity

97%

Appearance

Yellow powder

Complexity

220

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

188.058577502g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

188.058577502g/mol

Rotatable Bond Count

Topological Polar Surface Area

66Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

1.4

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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1002535-21-8
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