860788-97-2
Product Name:
DIMETHYL 2-ALLYL-2-[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]MALONATE
Formula:
C15H14F3NO6
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COMPUTED DESCRIPTORS
Molecular Weight | 361.27 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 7 |
Exact Mass | 361.07732165 g/mol |
Monoisotopic Mass | 361.07732165 g/mol |
Topological Polar Surface Area | 98.4 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 526 |
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 |