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35220-24-7 molecular structure
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ethyl 5-amino-2-methylimidazo[1,2-a]pyridine-3-carboxylate

ChemBase ID: 307999
Molecular Formular: C11H13N3O2
Molecular Mass: 219.23982
Monoisotopic Mass: 219.10077667
SMILES and InChIs

SMILES:
n12c(c(nc1cccc2N)C)C(=O)OCC
Canonical SMILES:
CCOC(=O)c1c(C)nc2n1c(N)ccc2
InChI:
InChI=1S/C11H13N3O2/c1-3-16-11(15)10-7(2)13-9-6-4-5-8(12)14(9)10/h4-6H,3,12H2,1-2H3
InChIKey:
RWHVYNZCSZKUSZ-UHFFFAOYSA-N

Cite this record

CBID:307999 http://www.chembase.cn/molecule-307999.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
ethyl 5-amino-2-methylimidazo[1,2-a]pyridine-3-carboxylate
IUPAC Traditional name
ethyl 5-amino-2-methylimidazo[1,2-a]pyridine-3-carboxylate
Synonyms
ethyl 5-amino-2-methylimidazo[1,2-a]pyridine-3-carboxylate
CAS Number
35220-24-7
MDL Number
MFCD10686551

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.40262187  LogD (pH = 7.4) 0.43119323 
Log P 0.43157068  Molar Refractivity 61.133 cm3
Polarizability 22.486753 Å3 Polar Surface Area 69.62 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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