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114460-94-5

114460-94-5 | Morpholine, 4-[1-(4-methoxyphenyl)-3-phenyl-2-propyn-1-yl]-

CAS No: 114460-94-5 Catalog No: AG000EFX MDL No:

Product Description

Catalog Number:
AG000EFX
Chemical Name:
Morpholine, 4-[1-(4-methoxyphenyl)-3-phenyl-2-propyn-1-yl]-
CAS Number:
114460-94-5
Molecular Formula:
C20H21NO2
Molecular Weight:
307.3862
IUPAC Name:
4-[1-(4-methoxyphenyl)-3-phenylprop-2-ynyl]morpholine
InChI:
InChI=1S/C20H21NO2/c1-22-19-10-8-18(9-11-19)20(21-13-15-23-16-14-21)12-7-17-5-3-2-4-6-17/h2-6,8-11,20H,13-16H2,1H3
InChI Key:
WZPQVBLPNJNKIF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(N1CCOCC1)C#Cc1ccccc1

Properties

Complexity:
404  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.157g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.393g/mol
Monoisotopic Mass:
307.157g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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