COMPUTED DESCRIPTORS
Molecular Weight | 105.09 g/mol |
---|---|
XLogP3 | -0.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 2 |
Exact Mass | 105.042593085 g/mol |
Monoisotopic Mass | 105.042593085 g/mol |
Topological Polar Surface Area | 66 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 57.7 |
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 |
PRODUCT INTRODUCTION
description
3-nitropropan-1-ol is the nitro compound formed from propan-1-ol by nitration at C-3. It is functionally related to a propan-1-ol.