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1009-93-4 molecular structure
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2,2,4,4,6,6-hexamethyl-1,3,5,2,4,6-triazatrisilinane

ChemBase ID: 147999
Molecular Formular: C6H21N3Si3
Molecular Mass: 219.50754
Monoisotopic Mass: 219.10432728
SMILES and InChIs

SMILES:
C[Si]1(N[Si](N[Si](N1)(C)C)(C)C)C
Canonical SMILES:
C[Si]1(C)N[Si](C)(C)N[Si](N1)(C)C
InChI:
InChI=1S/C6H21N3Si3/c1-10(2)7-11(3,4)9-12(5,6)8-10/h7-9H,1-6H3
InChIKey:
WGGNJZRNHUJNEM-UHFFFAOYSA-N

Cite this record

CBID:147999 http://www.chembase.cn/molecule-147999.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,2,4,4,6,6-hexamethyl-1,3,5,2,4,6-triazatrisilinane
IUPAC Traditional name
2,2,4,4,6,6-hexamethyl-1,3,5,2,4,6-triazatrisilinane
Synonyms
2,2,4,4,6,6-Hexamethylcyclotrisilazane
2,2,4,4,6,6-六甲基环三硅氮烷
CAS Number
1009-93-4
EC Number
213-773-6
MDL Number
MFCD00039698
Beilstein Number
774739
PubChem SID
162242179
24863418
PubChem CID
66094

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
376043 external link Add to cart Please log in.
Data Source Data ID
PubChem 66094 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -10.1033325  LogD (pH = 7.4) -7.1141815 
Log P -0.3753  Molar Refractivity 77.4189 cm3
Polarizability 24.430855 Å3 Polar Surface Area 36.09 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
-10 °C(lit.) expand Show data source
Boiling Point
188 °C/756 mmHg(lit.) expand Show data source
Flash Point
138.2 °F expand Show data source
59 °C expand Show data source
Density
0.92 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.445(lit.) expand Show data source
RTECS
GZ4720000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H226-H302-H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
Purity
97% expand Show data source
Empirical Formula (Hill Notation)
C6H21N3Si3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 376043 external link
Packaging
1, 10 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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