Home Other Building Blocks {4-[(3-phenylprop-2-yn-1-yl)oxy]phenyl}methanol

{4-[(3-phenylprop-2-yn-1-yl)oxy]phenyl}methanol

CAS No.:
1458051-40-5
Catalog Number:
AG01BD94
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
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Product Description
Catalog Number:
AG01BD94
Chemical Name:
{4-[(3-phenylprop-2-yn-1-yl)oxy]phenyl}methanol
CAS Number:
1458051-40-5
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
MDL Number:
MFCD17468286
IUPAC Name:
[4-(3-phenylprop-2-ynoxy)phenyl]methanol
InChI:
InChI=1S/C16H14O2/c17-13-15-8-10-16(11-9-15)18-12-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,12-13H2
InChI Key:
ITFGNKMKNRATAK-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)OCC#Cc1ccccc1
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties