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142770-76-1

142770-76-1 | 1-Hexanol, 6-[4-[2-(2-quinolinyl)ethenyl]phenoxy]-

CAS No: 142770-76-1 Catalog No: AG007ZA0 MDL No:

Product Description

Catalog Number:
AG007ZA0
Chemical Name:
1-Hexanol, 6-[4-[2-(2-quinolinyl)ethenyl]phenoxy]-
CAS Number:
142770-76-1
Molecular Formula:
C23H25NO2
Molecular Weight:
347.4501
IUPAC Name:
6-[4-(2-quinolin-2-ylethenyl)phenoxy]hexan-1-ol
InChI:
InChI=1S/C23H25NO2/c25-17-5-1-2-6-18-26-22-15-10-19(11-16-22)9-13-21-14-12-20-7-3-4-8-23(20)24-21/h3-4,7-16,25H,1-2,5-6,17-18H2
InChI Key:
DCPVEHYLLXXQKB-UHFFFAOYSA-N
SMILES:
OCCCCCCOc1ccc(cc1)C=Cc1ccc2c(n1)cccc2

Properties

Complexity:
403  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.189g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
347.458g/mol
Monoisotopic Mass:
347.189g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.2  

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