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13566-48-8 molecular structure
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4,6-dimethoxy-2-methylpyrimidine

ChemBase ID: 293721
Molecular Formular: C7H10N2O2
Molecular Mass: 154.1665
Monoisotopic Mass: 154.07422757
SMILES and InChIs

SMILES:
COc1cc(OC)nc(C)n1
Canonical SMILES:
COc1cc(OC)nc(n1)C
InChI:
InChI=1S/C7H10N2O2/c1-5-8-6(10-2)4-7(9-5)11-3/h4H,1-3H3
InChIKey:
FWQJAXMTUACMLK-UHFFFAOYSA-N

Cite this record

CBID:293721 http://www.chembase.cn/molecule-293721.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4,6-dimethoxy-2-methylpyrimidine
IUPAC Traditional name
4,6-dimethoxy-2-methylpyrimidine
Synonyms
2-Methyl-4,6-dimethoxypyrimidine
CAS Number
13566-48-8
PubChem SID
180679252
PubChem CID
11040904

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 11040904 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.4086148  LogD (pH = 7.4) 1.4152198 
Log P 1.4153047  Molar Refractivity 40.9001 cm3
Polarizability 15.3794365 Å3 Polar Surface Area 44.24 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

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