CAS 133676-09-2 (R)-2-Octyl 4-[4-(Hexyloxy)benzoyloxy]benzoate, ≥98%

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Liquid Crystal (LC) Materials

(R)-2-Octyl 4-[4-(Hexyloxy)benzoyloxy]benzoate, ≥98%

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Catalog Number

ACM133676092-1

Product Name

(R)-2-Octyl 4-[4-(Hexyloxy)benzoyloxy]benzoate, ≥98%

Structure

CAS

133676-09-2

Category

Liquid Crystal (LC) Materials

IUPAC Name

[4-[(2R)-octan-2-yl]oxycarbonylphenyl] 4-hexoxybenzoate

Molecular Weight

454.6g/mol

Molecular Formula

C28H38O5

Canonical SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCC

InChI

InChI=1S/C28H38O5/c1-4-6-8-10-12-22(3)32-27(29)23-15-19-26(20-16-23)33-28(30)24-13-17-25(18-14-24)31-21-11-9-7-5-2/h13-20,22H,4-12,21H2,1-3H3/t22-/m1/s1

InChI Key

PLGPDUBTEHIWRH-JOCHJYFZSA-N

Complexity

532

Covalently-Bonded Unit Count

Exact Mass

454.271924g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

454.271924g/mol

Rotatable Bond Count