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13822-56-5 molecular structure
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(3-aminopropyl)trimethoxysilane

ChemBase ID: 150271
Molecular Formular: C6H17NO3Si
Molecular Mass: 179.28958
Monoisotopic Mass: 179.09776994
SMILES and InChIs

SMILES:
CO[Si](CCCN)(OC)OC
Canonical SMILES:
NCCC[Si](OC)(OC)OC
InChI:
InChI=1S/C6H17NO3Si/c1-8-11(9-2,10-3)6-4-5-7/h4-7H2,1-3H3
InChIKey:
SJECZPVISLOESU-UHFFFAOYSA-N

Cite this record

CBID:150271 http://www.chembase.cn/molecule-150271.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(3-aminopropyl)trimethoxysilane
IUPAC Traditional name
(3-aminopropyl)trimethoxysilane
Synonyms
3-Aminopropyltrimethoxysilane
3-(Trimethoxysilyl)propylamine
(3-Aminopropyl)trimethoxysilane
3-(三甲氧基甲硅基)丙胺
(3-氨丙基)三甲氧基硅烷
CAS Number
13822-56-5
EC Number
237-511-5
MDL Number
MFCD00008206
Beilstein Number
2038118
PubChem SID
24856993
24846312
162244432
PubChem CID
83756

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 83756 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.5592415  LogD (pH = 7.4) -2.8549116 
Log P -0.1371  Molar Refractivity 39.405 cm3
Polarizability 18.362146 Å3 Polar Surface Area 53.71 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
liquid expand Show data source
Boiling Point
194°C expand Show data source
91-92 °C/15 mmHg(lit.) expand Show data source
Flash Point
194 °F expand Show data source
90 °C expand Show data source
90°C(194°F) expand Show data source
Density
1.02 expand Show data source
1.027 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4240 expand Show data source
n20/D 1.424 expand Show data source
n20/D 1.424(lit.) expand Show data source
Storage Warning
Air & Moisture Sensitive expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN2735 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
II expand Show data source
Risk Statements
34 expand Show data source
38-41 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
26-39 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H314-H318-H227 expand Show data source
H315-H318 expand Show data source
GHS Precautionary statements
P280-P303+P361+P353-P305+P351+P338-P310 expand Show data source
P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
Purity
≥97.0% (NT) expand Show data source
97% expand Show data source
Grade
purum expand Show data source
Linear Formula
H2N(CH2)3Si(OCH3)3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 281778 external link
Packaging
5, 100, 500 mL in glass bottle
Optically tunable core-shell composite nanorod structures have been prepared by depositing gold onto silica and titania nanorods which have been surface modified with (3-Aminopropyl)trimethoxysilane1

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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