879460-37-4
Product Name:
5-AMINO-1-(2-CHLORO-BENZYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
Formula:
C13H14ClN3O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 279.72 g/mol |
---|---|
XLogP3 | 2.9 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 5 |
Exact Mass | 279.0774544 g/mol |
Monoisotopic Mass | 279.0774544 g/mol |
Topological Polar Surface Area | 70.1 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 316 |
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 |