Summary
Fragment ID 27626
Isomeric SMILES c1ccc(cc1)c1ccco1
InChI N/A
InChI key N/A
Terminal False
Shared True
Unfragmented False
Rule Of Three True
Standard Atoms True
Butyl Linker None
Molecular Properties
MW 144.17
Heavy Atoms 11
Carbons 10
Heteroatoms 1
Halides 0
Het/Carb Ratio 0.1
Formal Charge Count 0
Formal Charge Sum 0
Chiral Centers 0
Bonds 12
Rotable Bonds 1
Ring Systems 2
Aromatic Ring Systems 2
Lipinski Hydrogen Bond Donors 0
Lipinski Hydrogen Bond Acceptors 1
Topological PSA 13.14
XLogP 2.718
Fraction C sp3 0.0