4-N-Hexylbiphenyl-4'-carboxylic acid

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Catalog Number

ACM59662485

Product Name

Structure

CAS

59662-48-5

Category

Heterocyclic Organic Compound

IUPAC Name

4-(4-hexylphenyl)benzoic acid

Molecular Weight

282.4g/mol

Molecular Formula

C19H22O2

Canonical SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H22O2/c1-2-3-4-5-6-15-7-9-16(10-8-15)17-11-13-18(14-12-17)19(20)21/h7-14H,2-6H2,1H3,(H,20,21)

InChI Key

ROJCBWVSXWIGAL-UHFFFAOYSA-N

Complexity

297

Covalently-Bonded Unit Count

Exact Mass

282.16198g/mol

Formal Charge

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

282.16198g/mol

Rotatable Bond Count

XLogP3

6.7

MSDS

COA

Spec Sheet

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