(E)-3-[3-(Trifluoromethyl)phenyl]-2-propen-1-ol - CAS 113048-69-4
Catalog: |
BB003093 |
Product Name: |
(E)-3-[3-(Trifluoromethyl)phenyl]-2-propen-1-ol |
CAS: |
113048-69-4 |
Synonyms: |
(E)-3-[3-(trifluoromethyl)phenyl]-2-propen-1-ol; (E)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-ol |
IUPAC Name: | (E)-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-ol |
Description: | (E)-3-[3-(Trifluoromethyl)phenyl]-2-propen-1-ol (CAS# 113048-69-4 ) is a useful research chemical. |
Molecular Weight: | 202.17 |
Molecular Formula: | C10H9F3O |
Canonical SMILES: | C1=CC(=CC(=C1)C(F)(F)F)C=CCO |
InChI: | InChI=1S/C10H9F3O/c11-10(12,13)9-5-1-3-8(7-9)4-2-6-14/h1-5,7,14H,6H2/b4-2+ |
InChI Key: | YDNLMIBCGPTFIK-DUXPYHPUSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 2.71090 |
Publication Number | Title | Priority Date |
US-2018155270-A1 | Process for preparation of cinacalcet intermediate and cinacalcet hydrochloride | 20150529 |
WO-2016193882-A1 | Process for preparation of cinacalcet intermediate and cinacalcet hydrochloride | 20150529 |
US-2012309842-A1 | Processes for the preparation of cinacalcet | 20090916 |
US-8759586-B2 | Processes for the preparation of cinacalcet | 20090916 |
WO-2011033473-A1 | Processes for the preparation of cinacalcet | 20090916 |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 202.06054939 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.06054939 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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