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872362-98-6 molecular structure
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{8-methylimidazo[1,2-a]pyridin-2-yl}methanol

ChemBase ID: 143674
Molecular Formular: C9H10N2O
Molecular Mass: 162.1885
Monoisotopic Mass: 162.07931295
SMILES and InChIs

SMILES:
Cc1cccn2c1nc(c2)CO
Canonical SMILES:
OCc1cn2c(n1)c(C)ccc2
InChI:
InChI=1S/C9H10N2O/c1-7-3-2-4-11-5-8(6-12)10-9(7)11/h2-5,12H,6H2,1H3
InChIKey:
USLQEDJXTXXZAC-UHFFFAOYSA-N

Cite this record

CBID:143674 http://www.chembase.cn/molecule-143674.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
{8-methylimidazo[1,2-a]pyridin-2-yl}methanol
IUPAC Traditional name
{8-methylimidazo[1,2-a]pyridin-2-yl}methanol
Synonyms
(8-Methylimidazo[1,2-a]pyridin-2-yl)methanol
(8-methylimidazo[1,2-a]pyridin-2-yl)methanol
CAS Number
872362-98-6
MDL Number
MFCD08752621
PubChem SID
162237891
PubChem CID
19735652

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 19735652 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 14.271299  H Acceptors
H Donor LogD (pH = 5.5) 0.04457274 
LogD (pH = 7.4) 0.57266456  Log P 0.58709294 
Molar Refractivity 47.2713 cm3 Polarizability 17.504164 Å3
Polar Surface Area 37.53 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Empirical Formula (Hill Notation)
C9H10N2O expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - CBR00543 external link
Other Notes
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Legal Information
Product of ChemBridge Corp.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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