1-(3-Fluorophenyl)cyclohexylamine - CAS 125827-86-3
Catalog: |
BB006268 |
Product Name: |
1-(3-Fluorophenyl)cyclohexylamine |
CAS: |
125827-86-3 |
Synonyms: |
1-(3-fluorophenyl)-1-cyclohexanamine; 1-(3-fluorophenyl)cyclohexan-1-amine |
IUPAC Name: | 1-(3-fluorophenyl)cyclohexan-1-amine |
Description: | 1-(3-Fluorophenyl)cyclohexylamine (CAS# 125827-86-3) is a useful research chemical. |
Molecular Weight: | 193.26 |
Molecular Formula: | C12H16FN |
Canonical SMILES: | C1CCC(CC1)(C2=CC(=CC=C2)F)N |
InChI: | InChI=1S/C12H16FN/c13-11-6-4-5-10(9-11)12(14)7-2-1-3-8-12/h4-6,9H,1-3,7-8,14H2 |
InChI Key: | JNWGVEKXINNKAU-UHFFFAOYSA-N |
Boiling Point: | 277.8 °C at 760 mmHg |
Density: | 1.068 g/cm3 |
LogP: | 3.64410 |
Publication Number | Title | Priority Date |
WO-2017214565-A1 | Methods of use and pharmaceutical combinations of hdac inhibitors with bet inhibitors | 20160609 |
US-2020323848-A1 | Methods of use and pharmaceutical combinations of hdac inhibitors with bet inhibitors | 20160609 |
US-2019209559-A1 | Hdac inhibitors, alone or in combination with btk inhibitors, for treating chronic lymphocytic leukemia | 20160419 |
WO-2017184774-A1 | Hdac inhibitors, alone or in combination with btk inhibitors, for treating chronic lymphocytic leukemia | 20160419 |
US-2019046529-A1 | Increasing expression of interferon regulated genes with combinatons of histone deacetylase inhibitors and immunomodulatory drugs | 20160217 |
PMID | Publication Date | Title | Journal |
17434739 | 20070615 | Adaptive neuro-fuzzy inference system (ANFIS): a new approach to predictive modeling in QSAR applications: a study of neuro-fuzzy modeling of PCP-based NMDA receptor antagonists | Bioorganic & medicinal chemistry |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.126677677 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.126677677 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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Amines and Anilines
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