1-Hydroxy-6-methoxy-1-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalene - CAS 188726-45-6
Catalog: |
BB014543 |
Product Name: |
1-Hydroxy-6-methoxy-1-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalene |
CAS: |
188726-45-6 |
Synonyms: |
6-methoxy-1-(trifluoromethyl)-3,4-dihydro-2H-naphthalen-1-ol; 6-methoxy-1-(trifluoromethyl)-3,4-dihydro-2H-naphthalen-1-ol |
IUPAC Name: | 6-methoxy-1-(trifluoromethyl)-3,4-dihydro-2H-naphthalen-1-ol |
Description: | 1-Hydroxy-6-methoxy-1-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalene (CAS# 188726-45-6 ) is a useful research chemical. |
Molecular Weight: | 246.23 |
Molecular Formula: | C12H13F3O2 |
Canonical SMILES: | COC1=CC2=C(C=C1)C(CCC2)(C(F)(F)F)O |
InChI: | InChI=1S/C12H13F3O2/c1-17-9-4-5-10-8(7-9)3-2-6-11(10,16)12(13,14)15/h4-5,7,16H,2-3,6H2,1H3 |
InChI Key: | KQQKDNLMXYUGGE-UHFFFAOYSA-N |
LogP: | 2.78140 |
Publication Number | Title | Priority Date |
CZ-297543-B6 | Substituted benzylaminopiperidines, their use and pharmaceutical compositions based thereon | 19950824 |
CZ-52198-A3 | Substituted benzylaminopiperidines and a pharmaceutical composition thereof | 19950824 |
HU-225480-B1 | Substituted benzylaminopiperidine derivatives, pharmaceutical compositions containing these compounds and use thereof | 19950824 |
JP-3084069-B2 | Substituted benzylaminopiperidine compounds | 19950824 |
KR-19990044077-A | Substituted Benzylaminopiperidine Compounds | 19950824 |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 246.08676414 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.08676414 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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