860786-21-6
Product Name:
2-[4-(3-FLUOROPHENYL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-1-YL]ACETONITRILE
Formula:
C11H9FN4O
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 232.21 g/mol |
---|---|
XLogP3 | 1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 232.07603909 g/mol |
Monoisotopic Mass | 232.07603909 g/mol |
Topological Polar Surface Area | 59.7 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 400 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-[4-(3-fluorophenyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]acetonitrile is a member of triazoles.