NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
2-[2-chloro(2H4)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione
|
|
|
IUPAC Traditional name
|
2-[2-chloro(2H4)ethyl]isoindole-1,3-dione
|
|
|
Synonyms
|
2-(2-Chloroethyl-1,1,2,2-d4)-1H-isoindole-1,3(2H)-dione
|
2-(2-Chloroethyl-d4)-1H-isoindole-1,3-dione
|
|
|
CAS Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
|
Data ID
|
Price
|
TRC
|
|
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
H Acceptors
|
2
|
H Donor
|
0
|
LogD (pH = 5.5)
|
1.581589
|
LogD (pH = 7.4)
|
1.581589
|
Log P
|
1.581589
|
Molar Refractivity
|
53.5548 cm3
|
Polarizability
|
19.698727 Å3
|
Polar Surface Area
|
37.38 Å2
|
Rotatable Bonds
|
2
|
Lipinski's Rule of Five
|
true
|
PATENTS
PATENTS
PubChem Patent
Google Patent