1-Cyclopropyl-2,2,2-trifluoroethanamine Hydrochloride - CAS 75702-99-7
Catalog: |
BB035377 |
Product Name: |
1-Cyclopropyl-2,2,2-trifluoroethanamine Hydrochloride |
CAS: |
75702-99-7 |
Synonyms: |
1-cyclopropyl-2,2,2-trifluoroethanamine;hydrochloride; 1-cyclopropyl-2,2,2-trifluoroethanamine;hydrochloride |
IUPAC Name: | 1-cyclopropyl-2,2,2-trifluoroethanamine;hydrochloride |
Description: | 1-Cyclopropyl-2,2,2-trifluoroethanamine Hydrochloride (CAS# 75702-99-7) is used as a reagent in the synthesis of 5H-pyrido[4,3-b]indole derivatives as janus kinases (JAK) inhibitors. |
Molecular Weight: | 175.58 |
Molecular Formula: | C5H9ClF3N |
Canonical SMILES: | C1CC1C(C(F)(F)F)N.Cl |
InChI: | InChI=1S/C5H8F3N.ClH/c6-5(7,8)4(9)3-1-2-3;/h3-4H,1-2,9H2;1H |
InChI Key: | SYGCZMSQFRLXRX-UHFFFAOYSA-N |
MDL: | MFCD23098781 |
LogP: | 2.78830 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021047287-A1 | Nonpeptide somatostatin type 5 receptor agonists and uses thereof | 20190814 |
US-2020155538-A1 | Quinoline derivatives | 20181030 |
WO-2020092375-A1 | Quinoline derivatives as alpha4beta7 integrin inhibitors | 20181030 |
TW-202033492-A | Quinoline derivatives | 20181030 |
CN-112969687-A | Quinoline derivatives as alpha 4 beta 7 integrin inhibitors | 20181030 |
Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.0375615 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.0375615 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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