4-(Trifluoromethyl)oxan-4-amine Hydrochloride - CAS 1354961-50-4
Catalog: |
BB008205 |
Product Name: |
4-(Trifluoromethyl)oxan-4-amine Hydrochloride |
CAS: |
1354961-50-4 |
Synonyms: |
4-(trifluoromethyl)-4-oxanamine;hydrochloride; 4-(trifluoromethyl)oxan-4-amine;hydrochloride |
IUPAC Name: | 4-(trifluoromethyl)oxan-4-amine;hydrochloride |
Description: | 4-(Trifluoromethyl)oxan-4-amine Hydrochloride (CAS# 1354961-50-4) is a useful research chemical. |
Molecular Weight: | 205.61 |
Molecular Formula: | C6H11ClF3NO |
Canonical SMILES: | C1COCCC1(C(F)(F)F)N.Cl |
InChI: | InChI=1S/C6H10F3NO.ClH/c7-6(8,9)5(10)1-3-11-4-2-5;/h1-4,10H2;1H |
InChI Key: | OWTXHERLFKABLD-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD20502079 |
LogP: | 2.55890 |
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 |
WO-2021014172-A1 | Pyridine derivatives as calcium-activated chloride channel modulators | 20190724 |
CA-2988468-A1 | Positive allosteric modulators of muscarinic m2 receptor | 20150609 |
EP-3307741-A1 | Positive allosteric modulators of muscarinic m2 receptor | 20150609 |
JP-2018516970-A | Positive allosteric modulator of muscarinic M2 receptor | 20150609 |
KR-20180016485-A | Positive allosteric modulator of muscarinic M2 receptor | 20150609 |
Complexity: | 139 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.0481262 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.0481262 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 35.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Amines and Anilines
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