391649-88-0
Product Name:
2-(2,2-DIMETHYLPROPANOYL)-3-(2-NITROPHENYL)PROP-2-ENENITRILE
Formula:
C14H14N2O3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 258.27 g/mol |
---|---|
XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 258.10044231 g/mol |
Monoisotopic Mass | 258.10044231 g/mol |
Topological Polar Surface Area | 86.7 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 446 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 1 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |