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124432-71-9 molecular structure
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5-fluoro-6-methoxypyridin-3-ol

ChemBase ID: 814444
Molecular Formular: C6H6FNO2
Molecular Mass: 143.1157432
Monoisotopic Mass: 143.03825666
SMILES and InChIs

SMILES:
n1cc(cc(c1OC)F)O
Canonical SMILES:
COc1ncc(cc1F)O
InChI:
InChI=1S/C6H6FNO2/c1-10-6-5(7)2-4(9)3-8-6/h2-3,9H,1H3
InChIKey:
PZHUZYCVIVBGQG-UHFFFAOYSA-N

Cite this record

CBID:814444 http://www.chembase.cn/molecule-814444.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-fluoro-6-methoxypyridin-3-ol
IUPAC Traditional name
5-fluoro-6-methoxypyridin-3-ol
Synonyms
5-fluoro-6-methoxypyridin-3-ol
CAS Number
124432-71-9

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O36610 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O36610 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 8.322835  H Acceptors
H Donor LogD (pH = 5.5) 1.0308505 
LogD (pH = 7.4) 0.9834576  Log P 1.0314963 
Molar Refractivity 32.8751 cm3 Polarizability 12.359999 Å3
Polar Surface Area 42.35 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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