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19539-50-5 molecular structure
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furo[2,3-c]pyridine

ChemBase ID: 64367
Molecular Formular: C7H5NO
Molecular Mass: 119.1207
Monoisotopic Mass: 119.03711379
SMILES and InChIs

SMILES:
c1oc2c(c1)ccnc2
Canonical SMILES:
c1ncc2c(c1)cco2
InChI:
InChI=1S/C7H5NO/c1-3-8-5-7-6(1)2-4-9-7/h1-5H
InChIKey:
ZYXBIOIYWUIXSM-UHFFFAOYSA-N

Cite this record

CBID:64367 http://www.chembase.cn/molecule-64367.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
furo[2,3-c]pyridine
IUPAC Traditional name
furo[2,3-c]pyridine
Synonyms
Furo[2,3-c]pyridine
CAS Number
19539-50-5
MDL Number
MFCD09955599
PubChem SID
162030106
PubChem CID
12826108

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Matrix Scientific
069693 external link Add to cart Please log in.
Data Source Data ID
PubChem 12826108 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.89458233  LogD (pH = 7.4) 0.9144363 
Log P 0.9146968  Molar Refractivity 32.7422 cm3
Polarizability 13.828259 Å3 Polar Surface Area 26.03 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
Storage Warning
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source
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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