4,4-difluorocyclohexanamine - CAS 458566-84-2
Catalog: |
BB026006 |
Product Name: |
4,4-difluorocyclohexanamine |
CAS: |
458566-84-2 |
Synonyms: |
4,4-difluoro-1-cyclohexanamine; 4,4-difluorocyclohexan-1-amine |
IUPAC Name: | 4,4-difluorocyclohexan-1-amine |
Description: | 4,4-difluorocyclohexanamine (CAS# 458566-84-2) is a useful research chemical. |
Molecular Weight: | 135.16 |
Molecular Formula: | C6H11F2N |
Canonical SMILES: | C1CC(CCC1N)(F)F |
InChI: | InChI=1S/C6H11F2N/c7-6(8)3-1-5(9)2-4-6/h5H,1-4,9H2 |
InChI Key: | MQOFXVWAFFJFJH-UHFFFAOYSA-N |
Boiling Point: | 141.2 °C at 760 mmHg |
Density: | 1.08 g/cm3 |
Appearance: | Solid |
LogP: | 2.22330 |
Publication Number | Title | Priority Date |
WO-2021212039-A1 | Inhibitors of cysteine proteases and methods of use thereof | 20200417 |
WO-2021203023-A1 | Indole derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd) | 20200403 |
WO-2021076448-A1 | Somatostatin modulators for treating pituitary adenomas | 20191014 |
WO-2021055612-A1 | Substituted imidazole carboxamides and their use in the treatment of medical disorders | 20190917 |
WO-2021038068-A1 | Alpha-d-galactopyranoside derivatives | 20190829 |
Complexity: | 93.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 135.08595568 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 135.08595568 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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