CAS 50649-64-4 4-n-Octyloxyphenyl 4-Pentylbenzoate

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4-n-Octyloxyphenyl 4-Pentylbenzoate

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Catalog Number

ACM50649644-1

CAS Number

50649-64-4

Product Name

4-n-Octyloxyphenyl 4-Pentylbenzoate

Structure

Category

Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials

Synonyms

4-Amylbenzoic Acid 4-n-Octyloxyphenyl Ester

IUPAC Name

(4-octoxyphenyl) 4-pentylbenzoate

Molecular Weight

396.56

Molecular Formula

C26H36O3

Canonical SMILES

CCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C26H36O3/c1-3-5-7-8-9-11-21-28-24-17-19-25(20-18-24)29-26(27)23-15-13-22(14-16-23)12-10-6-4-2/h13-20H,3-12,21H2,1-2H3

InChI Key

ITWWXCLUKGZJRY-UHFFFAOYSA-N

Purity

99%+

Solubility

slightly soluble in Methanol

Appearance

White to Light yellow to Light orange powder to crystal

Storage

Room temperature.

Complexity

406

Covalently-Bonded Unit Count

Exact Mass

396.266445g/mol

Formal Charge

Heavy Atom Count

MDL Number

MFCD00059446

Monoisotopic Mass

396.266445g/mol

Rotatable Bond Count

XLogP3

9.1

MSDS

Download MSDS

COA

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Spec Sheet

Download Spec Sheet

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