NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
|
IUPAC Traditional name
|
|
Synonyms
|
4-nitronaphthalen-1-ol
|
4-Nitro-1-naphthol
|
|
|
CAS Number
|
|
MDL Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
6.74041
|
H Acceptors
|
3
|
H Donor
|
1
|
LogD (pH = 5.5)
|
2.5750575
|
LogD (pH = 7.4)
|
1.8685677
|
Log P
|
2.5991414
|
Molar Refractivity
|
50.8096 cm3
|
Polarizability
|
20.297852 Å3
|
Polar Surface Area
|
63.37 Å2
|
Rotatable Bonds
|
1
|
Lipinski's Rule of Five
|
true
|
PATENTS
PATENTS
PubChem Patent
Google Patent