(R)-2-(4-Fluorophenyl)-3-methylbutyric Acid - CAS 110311-45-0
Catalog: |
BB002611 |
Product Name: |
(R)-2-(4-Fluorophenyl)-3-methylbutyric Acid |
CAS: |
110311-45-0 |
Synonyms: |
(2R)-2-(4-fluorophenyl)-3-methylbutanoic acid; (2R)-2-(4-fluorophenyl)-3-methylbutanoic acid |
IUPAC Name: | (2R)-2-(4-fluorophenyl)-3-methylbutanoic acid |
Description: | (R)-2-(4-Fluorophenyl)-3-methylbutyric Acid (CAS# 110311-45-0 ) is a useful research chemical. |
Molecular Weight: | 196.22 |
Molecular Formula: | C11H13FO2 |
Canonical SMILES: | CC(C)C(C1=CC=C(C=C1)F)C(=O)O |
InChI: | InChI=1S/C11H13FO2/c1-7(2)10(11(13)14)8-3-5-9(12)6-4-8/h3-7,10H,1-2H3,(H,13,14)/t10-/m1/s1 |
InChI Key: | YBQLHBYGMUXCEW-SNVBAGLBSA-N |
LogP: | 2.64990 |
Publication Number | Title | Priority Date |
AU-2015233642-A1 | 2,7-diazaspiro[3.5]nonane compounds | 20140317 |
CN-106103439-A | 2,7 diaza spiros [3.5] nonane compound | 20140317 |
CN-106103439-B | 2,7- diaza spiro [3.5] nonane compound | 20140317 |
DK-3119782-T3 | 2,7-diazaspiro [3.5] NONANFORBINDELSER | 20140317 |
EP-3119782-A1 | 2,7-diazaspiro[3.5]nonane compounds | 20140317 |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.08995782 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.08995782 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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