869943-05-5
Product Name:
2-[(3-METHYL-THIOPHEN-2-YLMETHYL)-AMINO]-BUTAN-1-OL
Formula:
C10H17NOS
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 26.6 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 199.32 g/mol |
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XLogP3 | 1.6 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 5 |
Exact Mass | 199.10308534 g/mol |
Monoisotopic Mass | 199.10308534 g/mol |
Topological Polar Surface Area | 60.5 Ų |
Heavy Atom Count | 13 |
Formal Charge | 0 |
Complexity | 143 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |