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23779-32-0 molecular structure
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[3-(triethoxysilyl)propyl]urea

ChemBase ID: 108062
Molecular Formular: C10H24N2O4Si
Molecular Mass: 264.39406
Monoisotopic Mass: 264.15053379
SMILES and InChIs

SMILES:
CCO[Si](CCCNC(=O)N)(OCC)OCC
Canonical SMILES:
CCO[Si](OCC)(OCC)CCCNC(=O)N
InChI:
InChI=1S/C10H24N2O4Si/c1-4-14-17(15-5-2,16-6-3)9-7-8-12-10(11)13/h4-9H2,1-3H3,(H3,11,12,13)
InChIKey:
LVNLBBGBASVLLI-UHFFFAOYSA-N

Cite this record

CBID:108062 http://www.chembase.cn/molecule-108062.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
[3-(triethoxysilyl)propyl]urea
IUPAC Traditional name
3-(triethoxysilyl)propylurea
Synonyms
[3-[Tri(ethoxy/methoxy)silyl]propyl]urea solution
3-Ureidopropyltriethoxysilane
N-(TRIETHOXYSILYLPROPYL)UREA
[3-[三(乙氧基/甲氧基)甲硅烷基]丙基]脲 溶液
CAS Number
23779-32-0
116912-64-2
MDL Number
MFCD00047877
PubChem SID
24865862
162093803
PubChem CID
90258

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 90258 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 15.257364  H Acceptors
H Donor LogD (pH = 5.5) 0.44579998 
LogD (pH = 7.4) 0.4458  Log P 0.4458 
Molar Refractivity 61.7713 cm3 Polarizability 26.589836 Å3
Polar Surface Area 82.81 Å2 Rotatable Bonds 10 
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Flash Point
14 °C expand Show data source
58 °F expand Show data source
Density
0.91 g/mL at 25 °C expand Show data source
Refractive Index
n20/D 1.39 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
1866 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Hazard Class
3 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
11 expand Show data source
Safety Statements
16-23-45 expand Show data source
RID/ADR
UN 1866 3/PG 2 expand Show data source
Concentration
50 wt. % in methanol expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
(RO)3Si(CH2)3NHCONH2, R = -CH3 or -CH2CH3 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05205930 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 413372 external link
Packaging
50 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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