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1186310-77-9 molecular structure
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6-chloro-2-(trimethylsilyl)furo[3,2-b]pyridine

ChemBase ID: 44982
Molecular Formular: C10H12ClNOSi
Molecular Mass: 225.74688
Monoisotopic Mass: 225.03766822
SMILES and InChIs

SMILES:
c1(cnc2c(c1)oc(c2)[Si](C)(C)C)Cl
Canonical SMILES:
Clc1cnc2c(c1)oc(c2)[Si](C)(C)C
InChI:
InChI=1S/C10H12ClNOSi/c1-14(2,3)10-5-8-9(13-10)4-7(11)6-12-8/h4-6H,1-3H3
InChIKey:
WUQLUIMCZRXJGD-UHFFFAOYSA-N

Cite this record

CBID:44982 http://www.chembase.cn/molecule-44982.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
6-chloro-2-(trimethylsilyl)furo[3,2-b]pyridine
IUPAC Traditional name
6-chloro-2-(trimethylsilyl)furo[3,2-b]pyridine
Synonyms
6-Chloro-2-(trimethylsilyl)furo[3,2-b]pyridine
6-Chloro-2-(trimethylsilyl)furo[3,2-b]pyridine
CAS Number
1186310-77-9
MDL Number
MFCD12922807
PubChem SID
162049745
PubChem CID
46737947

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 46737947 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.4578795  LogD (pH = 7.4) 3.4578998 
Log P 3.4579  Molar Refractivity 52.4919 cm3
Polarizability 24.154577 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
Download expand Show data source
TSCA Listed
false expand Show data source
Empirical Formula (Hill Notation)
C10H12ClNOSi expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - ADE001189 external link
Other Notes
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Legal Information
Product of Adesis

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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