1-[3-(Trifluoromethyl)phenyl]cyclopentanecarboxylic Acid - CAS 878217-65-3
Catalog: |
BB038653 |
Product Name: |
1-[3-(Trifluoromethyl)phenyl]cyclopentanecarboxylic Acid |
CAS: |
878217-65-3 |
Synonyms: |
1-[3-(trifluoromethyl)phenyl]-1-cyclopentanecarboxylic acid; 1-[3-(trifluoromethyl)phenyl]cyclopentane-1-carboxylic acid |
IUPAC Name: | 1-[3-(trifluoromethyl)phenyl]cyclopentane-1-carboxylic acid |
Description: | 1-[3-(Trifluoromethyl)phenyl]cyclopentanecarboxylic Acid (CAS# 878217-65-3) is a useful research chemical. |
Molecular Weight: | 258.24 |
Molecular Formula: | C13H13F3O2 |
Canonical SMILES: | C1CCC(C1)(C2=CC(=CC=C2)C(F)(F)F)C(=O)O |
InChI: | InChI=1S/C13H13F3O2/c14-13(15,16)10-5-3-4-9(8-10)12(11(17)18)6-1-2-7-12/h3-5,8H,1-2,6-7H2,(H,17,18) |
InChI Key: | APRXSIMKSSZHHM-UHFFFAOYSA-N |
LogP: | 3.60180 |
Publication Number | Title | Priority Date |
EP-2914592-B1 | Inhibitors of cytomegalovirus | 20121103 |
US-2015284348-A1 | Inhibitors of cytomegalovirus | 20121103 |
US-9334249-B2 | Inhibitors of cytomegalovirus | 20121103 |
WO-2014070979-A1 | Inhibitors of cytomegalovirus | 20121103 |
EP-2060563-A1 | Cyclic aminoalkylcarboxamide derivative | 20060908 |
Complexity: | 319 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.08676414 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.08676414 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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