288839-72-5
Product Name:
1-Isoquinolineacetic acid,1,2,3,4-tetrahydro-,ethyl ester,(1S)-
Formula:
C13H17NO2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 219.28 g/mol |
---|---|
XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 219.125928785 g/mol |
Monoisotopic Mass | 219.125928785 g/mol |
Topological Polar Surface Area | 38.3 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 242 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 1 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |