CAS 1036248-62-0 1,4-di(1H-pyrazol-4-yl)benzene

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1,4-di(1H-pyrazol-4-yl)benzene

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Catalog Number

ACM1036248620-2

CAS Number

1036248-62-0

Product Name

1,4-di(1H-pyrazol-4-yl)benzene

Category

Nitrogen-containing MOF ligand-binary nitrogen-containing MOF ligand

Synonyms

1,4-benzenedi(4'-pyrazolyl)

IUPAC Name

4-[4-(1H-pyrazol-4-yl)phenyl]-1H-pyrazole

Molecular Weight

210.23

Molecular Formula

C12H10N4

InChI

RUGLQPNWHSDVER-UHFFFAOYSA-N

InChI Key

InChI=1S/C12H10N4/c1-2-10(12-7-15-16-8-12)4-3-9(1)11-5-13-14-6-11/h1-8H,(H,13,14)(H,15,16)

Melting Point

>360 °C

Purity

96%

Appearance

Brown powder

Complexity

201

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

210.090546336g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isomeric SMILES

C1=CC(=CC=C1C2=CNN=C2)C3=CNN=C3

Isotope Atom Count

Monoisotopic Mass

210.090546336g/mol

Rotatable Bond Count

Topological Polar Surface Area

57.4Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

1.8

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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