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54920-82-0 molecular structure
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1,7-naphthyridin-2-ol

ChemBase ID: 798850
Molecular Formular: C8H6N2O
Molecular Mass: 146.14604
Monoisotopic Mass: 146.04801282
SMILES and InChIs

SMILES:
c1c(nc2cnccc2c1)O
Canonical SMILES:
Oc1ccc2c(n1)cncc2
InChI:
InChI=1S/C8H6N2O/c11-8-2-1-6-3-4-9-5-7(6)10-8/h1-5H,(H,10,11)
InChIKey:
FQAJSEWFBJSSOY-UHFFFAOYSA-N

Cite this record

CBID:798850 http://www.chembase.cn/molecule-798850.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1,7-naphthyridin-2-ol
IUPAC Traditional name
1,7-naphthyridin-2-ol
Synonyms
1,7-naphthyridin-2-ol
CAS Number
54920-82-0

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O12500 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O12500 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 11.436785  H Acceptors
H Donor LogD (pH = 5.5) 1.2002851 
LogD (pH = 7.4) 1.2040323  Log P 1.2041203 
Molar Refractivity 40.1168 cm3 Polarizability 16.662039 Å3
Polar Surface Area 46.01 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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