317842-48-1
Product Name:
Carbamic acid, (4-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI)
Formula:
C13H15NO2
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COMPUTED DESCRIPTORS
Molecular Weight | 217.26 g/mol |
---|---|
XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 217.110278721 g/mol |
Monoisotopic Mass | 217.110278721 g/mol |
Topological Polar Surface Area | 38.3 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 287 |
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 |