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4'-Hexylacetophenone

Catalog Number
ACM37592726-1
CAS Number
37592-72-6
Product Name
4'-Hexylacetophenone
Structure
Category
Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials
IUPAC Name
1-(4-hexylphenyl)ethanone
Molecular Weight
204.31g/mol
Molecular Formula
C14H20O
Canonical SMILES
CCCCCCC1=CC=C(C=C1)C(=O)C
InChI
InChI=1S/C14H20O/c1-3-4-5-6-7-13-8-10-14(11-9-13)12(2)15/h8-11H,3-7H2,1-2H3
InChI Key
WWBVHJKFJZBRSO-UHFFFAOYSA-N
Complexity
178
Covalently-Bonded Unit Count
1
Exact Mass
204.151415g/mol
Formal Charge
0
Heavy Atom Count
15
Monoisotopic Mass
204.151415g/mol
Rotatable Bond Count
6
XLogP3
4.3
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