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4-(Undecyloxy)benzoic acid

Catalog Number
ACM15872443-3
CAS Number
15872-44-3
Product Name
4-(Undecyloxy)benzoic acid
Structure
Category
Liquid Crystal (LC) Materials
IUPAC Name
4-undecoxybenzoic acid
Molecular Weight
292.4g/mol
Molecular Formula
C18H28O3
Canonical SMILES
CCCCCCCCCCCOC1=CC=C(C=C1)C(=O)O
InChI
InChI=1S/C18H28O3/c1-2-3-4-5-6-7-8-9-10-15-21-17-13-11-16(12-14-17)18(19)20/h11-14H,2-10,15H2,1H3,(H,19,20)
InChI Key
NEJZHJHZOUISSH-UHFFFAOYSA-N
Complexity
257
Covalently-Bonded Unit Count
1
Exact Mass
292.203845g/mol
Formal Charge
0
Heavy Atom Count
21
Monoisotopic Mass
292.203845g/mol
Rotatable Bond Count
12
XLogP3
6.6
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