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1-Ethoxy-4-[2-(4-methylphenyl)ethynyl]benzene

Catalog Number
ACM116903469
CAS Number
116903-46-9
Product Name
1-Ethoxy-4-[2-(4-methylphenyl)ethynyl]benzene
Structure
Category
Liquid Crystal (LC) Materials
Synonyms
1-ETHOXY-4-(2-P-TOLYLETHYNYL)BENZENE;1-Ethoxy-4-[2-(4-methylphenyl)ethynyl]benzene
IUPAC Name
1-ethoxy-4-[2-(4-methylphenyl)ethynyl]benzene
Molecular Weight
236.31g/mol
Molecular Formula
C17H16O
Canonical SMILES
CCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C
InChI
InChI=1S/C17H16O/c1-3-18-17-12-10-16(11-13-17)9-8-15-6-4-14(2)5-7-15/h4-7,10-13H,3H2,1-2H3
InChI Key
DURDZFYGFXPFAV-UHFFFAOYSA-N
Density
1.06
Complexity
292
Covalently-Bonded Unit Count
1
EC Number
601-457-4
Exact Mass
236.120115g/mol
Formal Charge
0
Heavy Atom Count
18
Monoisotopic Mass
236.120115g/mol
Rotatable Bond Count
4
XLogP3
4.6
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