303995-45-1
Product Name:
4-[2-(3-METHYL-4-NITRO-5-ISOXAZOLYL)VINYL]BENZENECARBALDEHYDE
Formula:
C13H10N2O4
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 258.23 g/mol |
---|---|
XLogP3 | 2.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
Exact Mass | 258.06405680 g/mol |
Monoisotopic Mass | 258.06405680 g/mol |
Topological Polar Surface Area | 88.9 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 358 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |