NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
(1R,4S)-4-hydroxy-5,5-dimethylcyclopent-2-en-1-yl acetate
|
|
|
IUPAC Traditional name
|
(1R,4S)-4-hydroxy-5,5-dimethylcyclopent-2-en-1-yl acetate
|
|
|
Synonyms
|
(1S,4R)-4-acetoxy-5,5-dimethyl-2-cyclopentene-1-ol
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
14.246572
|
H Acceptors
|
2
|
H Donor
|
1
|
LogD (pH = 5.5)
|
0.7393061
|
LogD (pH = 7.4)
|
0.73930603
|
Log P
|
0.7393061
|
Molar Refractivity
|
45.0198 cm3
|
Polarizability
|
17.74087 Å3
|
Polar Surface Area
|
46.53 Å2
|
Rotatable Bonds
|
2
|
Lipinski's Rule of Five
|
true
|
PROPERTIES
PROPERTIES
Product Information
Bioassay(PubChem)
Purity
|
97%
|
Show
data source
|
|
PATENTS
PATENTS
PubChem Patent
Google Patent