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13737-04-7 molecular structure
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2-(trimethylsilyl)pyridine

ChemBase ID: 77671
Molecular Formular: C8H13NSi
Molecular Mass: 151.28102
Monoisotopic Mass: 151.08172595
SMILES and InChIs

SMILES:
n1c(cccc1)[Si](C)(C)C
Canonical SMILES:
C[Si](c1ccccn1)(C)C
InChI:
InChI=1S/C8H13NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1-3H3
InChIKey:
IBLKFJNZUSUTPB-UHFFFAOYSA-N

Cite this record

CBID:77671 http://www.chembase.cn/molecule-77671.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(trimethylsilyl)pyridine
IUPAC Traditional name
2-(trimethylsilyl)pyridine
Synonyms
2-(Trimethylsilyl)pyridine
2-(Trimethylsilyl)pyridine
2-三甲硅基吡啶
2-(三甲基硅)吡啶
CAS Number
13737-04-7
MDL Number
MFCD06797181
PubChem SID
24883906
162042543
24883715
PubChem CID
139573

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.8258755  LogD (pH = 7.4) 3.0148444 
Log P 3.0179  Molar Refractivity 40.2782 cm3
Polarizability 17.897573 Å3 Polar Surface Area 12.89 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
47-49 °C/5 mmHg(lit.) expand Show data source
47-49°C/5mm expand Show data source
47-49°C/5mm expand Show data source
Flash Point
125.6 °F expand Show data source
52 °C expand Show data source
52°C expand Show data source
52°C(126°F) expand Show data source
Density
0.911 expand Show data source
0.9113 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.489 expand Show data source
1.4890 expand Show data source
n20/D 1.489(lit.) expand Show data source
Storage Warning
Irritant expand Show data source
Light Sensitive expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
UN Number
1993 expand Show data source
UN1993 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
3 expand Show data source
III expand Show data source
Risk Statements
10-36/37/38 expand Show data source
Safety Statements
16-26-36 expand Show data source
23-26-37 expand Show data source
TSCA Listed
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-H315-H319-H335 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
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
RID/ADR
UN 1993 3/PG 3 expand Show data source
Purity
97% expand Show data source
98% expand Show data source
Empirical Formula (Hill Notation)
C8H13NSi expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 649856 external link
包装
1, 10 g in glass bottle
Sigma Aldrich - 652849 external link
Packaging
1, 10 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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