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7288-28-0 molecular structure
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5-methyl-2,4-bis[(trimethylsilyl)oxy]pyrimidine

ChemBase ID: 140113
Molecular Formular: C11H22N2O2Si2
Molecular Mass: 270.47558
Monoisotopic Mass: 270.12198102
SMILES and InChIs

SMILES:
Cc1cnc(nc1O[Si](C)(C)C)O[Si](C)(C)C
Canonical SMILES:
Cc1cnc(nc1O[Si](C)(C)C)O[Si](C)(C)C
InChI:
InChI=1S/C11H22N2O2Si2/c1-9-8-12-11(15-17(5,6)7)13-10(9)14-16(2,3)4/h8H,1-7H3
InChIKey:
DRNUNECHVNIYHQ-UHFFFAOYSA-N

Cite this record

CBID:140113 http://www.chembase.cn/molecule-140113.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-methyl-2,4-bis[(trimethylsilyl)oxy]pyrimidine
IUPAC Traditional name
5-methyl-2,4-bis[(trimethylsilyl)oxy]pyrimidine
Synonyms
O,O′-Bis(trimethylsilyl)thymine
O,O′-二(三甲基甲硅烷基)胸苷
CAS Number
7288-28-0
MDL Number
MFCD00053571
PubChem SID
24849905
162234357
PubChem CID
81705

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
161101 external link Add to cart Please log in.
Data Source Data ID
PubChem 81705 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.1685624  LogD (pH = 7.4) 4.169686 
Log P 4.1697  Molar Refractivity 64.2366 cm3
Polarizability 28.60363 Å3 Polar Surface Area 44.24 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
73-75 °C(lit.) expand Show data source
Boiling Point
127-130 °C/18 mmHg(lit.) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Purity
97% expand Show data source
Empirical Formula (Hill Notation)
C11H22N2O2Si2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 161101 external link
Packaging
1, 5 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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