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85583-83-1 | 1-n-Butyl-4-[(4-ethoxyphenyl)ethynyl]benzene, 99+%
CAS No: 85583-83-1 Catalog No: AG003EK4 MDL No:
Product Description
Catalog Number:
AG003EK4
Chemical Name:
1-n-Butyl-4-[(4-ethoxyphenyl)ethynyl]benzene, 99+%
CAS Number:
85583-83-1
IUPAC Name:
1-butyl-4-[2-(4-ethoxyphenyl)ethynyl]benzene
InChI:
InChI=1S/C20H22O/c1-3-5-6-17-7-9-18(10-8-17)11-12-19-13-15-20(16-14-19)21-4-2/h7-10,13-16H,3-6H2,1-2H3
InChI Key:
ULERJJLPGXLNFM-UHFFFAOYSA-N
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.167g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.395g/mol
Monoisotopic Mass:
278.167g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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