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4-Butoxyphenyl 4-Pentylbenzoate, ≥99%

Catalog Number
ACM51128246-2
Product Name
4-Butoxyphenyl 4-Pentylbenzoate, ≥99%
Structure
CAS
51128-24-6
Category
Liquid Crystal (LC) Materials
IUPAC Name
(4-butoxyphenyl) 4-pentylbenzoate
Molecular Weight
340.5g/mol
Molecular Formula
C22H28O3
Canonical SMILES
CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCC
InChI
InChI=1S/C22H28O3/c1-3-5-7-8-18-9-11-19(12-10-18)22(23)25-21-15-13-20(14-16-21)24-17-6-4-2/h9-16H,3-8,17H2,1-2H3
InChI Key
LEJYVZMFIRFBCQ-UHFFFAOYSA-N
Complexity
352
Covalently-Bonded Unit Count
1
Exact Mass
340.203845g/mol
Formal Charge
0
Heavy Atom Count
25
Monoisotopic Mass
340.203845g/mol
Rotatable Bond Count
11
XLogP3
7
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