3-Fluoro-4-N-octyloxybenzoic acid

Name: 3-Fluoro-4-N-octyloxybenzoic acid
SKU: ACM326783
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Catalog NumberACM326783

CAS Number326-78-3

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

IUPAC Name

3-fluoro-4-octoxybenzoic acid

Molecular Weight

268.32g/mol

Molecular Formula

C15H21FO3

Canonical SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F

InChI

InChI=1S/C15H21FO3/c1-2-3-4-5-6-7-10-19-14-9-8-12(15(17)18)11-13(14)16/h8-9,11H,2-7,10H2,1H3,(H,17,18)

InChI Key

SQVFTDZEUGEJTQ-UHFFFAOYSA-N

Complexity

258

Covalently-Bonded Unit Count

Exact Mass

268.147473g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

268.147473g/mol

Rotatable Bond Count

XLogP3

4.9

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