CAS 1246015-46-2 Hexaphthalic acid - Materials / Alfa Chemistry

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Hexaphthalic acid

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Catalog Number

ACM1246015462-1

CAS Number

1246015-46-2

Product Name

Hexaphthalic acid

Category

Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand

Synonyms

[1,1':4',1'':4'',1''':4''',1'''':4'''',1'''''-Sexiphenyl]-4,4'''''-dicarboxylic acid

IUPAC Name

4-[4-[4-[4-[4-(4-carboxyphenyl)phenyl]phenyl]phenyl]phenyl]benzoic acid

Molecular Weight

546.61

Molecular Formula

C38H26O4

InChI

InChI=1S/C38H26O4/c39-37(40)35-21-17-33(18-22-35)31-13-9-29(10-14-31)27-5-1-25(2-6-27)26-3-7-28(8-4-26)30-11-15-32(16-12-30)34-19-23-36(24-20-34)38(41)42/h1-24H,(H,39,40)(H,41,42)

InChI Key

WZYFHDBTDJEEAC-UHFFFAOYSA-N

Purity

95%

Complexity

780

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

Exact Mass

546.18310931g/mol

Formal Charge

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

Monoisotopic Mass

546.18310931g/mol

Rotatable Bond Count

Stability

[1,1':4',1'':4'',1''':4''',1'''':4'''',1'''''-Sexiphenyl ]-4,4'''''-dicarboxylic acidLogged in to view

Topological Polar Surface Area

74.6Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

9.1

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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