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862201-39-6

862201-39-6 | 2-(p-Fluorophenyl)-4-phenylpyrrole

CAS No: 862201-39-6 Catalog No: AG004JTV MDL No:

Product Description

Catalog Number:
AG004JTV
Chemical Name:
2-(p-Fluorophenyl)-4-phenylpyrrole
CAS Number:
862201-39-6
Molecular Formula:
C16H12FN
Molecular Weight:
237.2716
IUPAC Name:
2-(4-fluorophenyl)-4-phenyl-1H-pyrrole
InChI:
InChI=1S/C16H12FN/c17-15-8-6-13(7-9-15)16-10-14(11-18-16)12-4-2-1-3-5-12/h1-11,18H
InChI Key:
MNAIQRBWMWDEIR-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1[nH]cc(c1)c1ccccc1

Properties

Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.277g/mol
Monoisotopic Mass:
237.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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