Home Other Building Blocks 4-(4-Fluorophenylethynyl)phenol

4-(4-Fluorophenylethynyl)phenol

CAS No.:
197770-48-2
Catalog Number:
AG002B0O
Molecular Formula:
C14H9FO
Molecular Weight:
212.2191
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Product Description
Catalog Number:
AG002B0O
Chemical Name:
4-(4-Fluorophenylethynyl)phenol
CAS Number:
197770-48-2
Molecular Formula:
C14H9FO
Molecular Weight:
212.2191
MDL Number:
MFCD02093472
IUPAC Name:
4-[2-(4-fluorophenyl)ethynyl]phenol
InChI:
InChI=1S/C14H9FO/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10,16H
InChI Key:
LIPHCUGEWJPCQB-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C#Cc1ccc(cc1)F
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.223g/mol
Monoisotopic Mass:
212.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties