NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide
|
|
|
IUPAC Traditional name
|
1-(2-oxo-2-phenylethyl)pyridin-1-ium bromide
|
|
|
Synonyms
|
1-phenyl-2-pyridinium-1-ylethan-1-one bromide
|
N-Phenacylpyridinium bromide
|
N-(Benzoylmethyl)pyridinium bromide
|
N-(苄甲基)溴化吡啶
|
|
|
CAS Number
|
|
EC Number
|
|
MDL Number
|
|
Beilstein Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
15.027924
|
H Acceptors
|
1
|
H Donor
|
0
|
LogD (pH = 5.5)
|
-1.9555726
|
LogD (pH = 7.4)
|
-1.9555726
|
Log P
|
-1.9555726
|
Molar Refractivity
|
59.9582 cm3
|
Polarizability
|
23.005621 Å3
|
Polar Surface Area
|
20.95 Å2
|
Rotatable Bonds
|
3
|
Lipinski's Rule of Five
|
true
|
PATENTS
PATENTS
PubChem Patent
Google Patent