Benzene, (2-(trimethoxysilyl)ethyl)-
Basic information
- CAS
49539-88-0- Standard SMILES
CO[Si](CCc1ccccc1)(OC)OC- InChIKey
UBMUZYGBAGFCDF-UHFFFAOYSA-N- Molecular formula
- C11H18O3Si
- Average molar mass
- 226.34 g/mol
- Monoisotopic mass
- 226.10252097
Names & identifiers
- Preferred name
- Benzene, (2-(trimethoxysilyl)ethyl)-
- IUPAC
- trimethoxy(2-phenylethyl)silane
- English name
- Phenethyltrimethoxysilane
- Molecular formula
- C11H18O3Si
- Molecular weight
- 226.34
Names & synonyms
Trimethoxy(2-phenylethyl)silane49539-88-0Phenethyltrimethoxysilane(Phenylethyl)trimethoxysilaneSilane, trimethoxy(2-phenylethyl)-Benzene, (2-(trimethoxysilyl)ethyl)-EINECS 256-363-2DTXSID5068495Benzene, [2-(trimethoxysilyl)ethyl]-RefChem:562107DTXCID3040695256-363-2
Show more names
DK311rimethoxy(2-phenylethyl)silanePhenethyltrimethoxysilane, 97.5%SILANE,TRIMETHOXY(2-PHENYLETHYL)PHENETHYLTRIMETHOXYSILANE, tech-95[2-(Trimethoxysilyl)Ethyl]-Benzene
trimethoxy(phenethyl)silaneTrimethoxy(2-phenylethyl)silane [contains ca. 25% Trimethoxy(1-phenylethyl)silane](2-Phenylethyl)trimethoxysilaneMFCD00053852phenylethyltrimethoxysilaneS13250Trimethoxy(2-phenylethyl)silane, 98%CS-0187704
Database identifiers
- CAS
49539-88-0- PubChem CID
- 170789
- DTXSID
DTXSID5068495- UNII
- 9N3F279Y3X
- EC Number
- 256-363-2
- Nikkaji
- J308.232F
Properties
Computed structural properties
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 157
Physicochemical properties
- Melting point
- 0 °C · <0°C
- Boiling point
- 95 · 95-96 °C/2 mmHg (lit.)
- Density
- 1.033 g/mL · 1.033 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.475(lit.)
- Flash point
- 228 °F · 228 °F
- storage temp.
- Store at room temperature
- form
- liquid
- Specific Gravity
- 1.037 · 1.037
- color
- Colorless to Light yellow to Red
- Hydrolytic Sensitivity
- 7 · 7: reacts slowly with moisture/water
- BRN
- 3031224 · 3031224
- InChI
- 1S/C11H18O3Si/c1-12-15(13-2,14-3)10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
- InChIKey
- UBMUZYGBAGFCDF-UHFFFAOYSA-N
- SMILES
- CO[Si](CCc1ccccc1)(OC)OC
- EPA Substance Registry System
- Silane, trimethoxy(2-phenylethyl)- (49539-88-0)
- UNSPSC Code
- 12352103 · 12352103
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 10-21
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29319090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-26/36
- Storage Class
- 10 - Combustible liquids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, [2-(trimethoxysilyl)ethyl]-: ACTIVE
Applications
UsesTrimethoxy(2-phenylethyl)silane is used in the loading and releasing of two anti-cancer drugs, 9-Aminoacridine (9AA) and Camptothecin (CPT) from magnetic mesoporous silica nanoparticle materials.
General DescriptionTrimethoxy(2-phenylethyl)silane (TMPES) is a phenyl functionalized trialkoxy silane that can be used as a siloxane based precursor.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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