2-Phenyl-2-((trimethylsilyl)oxy)acetonitrile
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Basic information
- CAS
25438-37-3- Standard SMILES
C[Si](C)(C)OC(C#N)c1ccccc1- InChIKey
DTAFQWDNWAXRLX-UHFFFAOYSA-N- Molecular formula
- C11H15NOSi
- Average molar mass
- 205.33 g/mol
- Monoisotopic mass
- 205.09229063
Names & identifiers
- Preferred name
- 2-Phenyl-2-((trimethylsilyl)oxy)acetonitrile
- IUPAC
- 2-phenyl-2-trimethylsilyloxyacetonitrile
- English name
- ALPHA-(TRIMETHYLSILYLOXY)PHENYLACETONIT&
- Molecular formula
- C11H15NOSi
- Molecular weight
- 205.33
Names & synonyms
2-PHENYL-2-[(TRIMETHYLSILYL)OXY]ACETONITRILE2-Phenyl-2-((trimethylsilyl)oxy)acetonitrileRefChem:478018624-871-725438-37-3Phenyl-trimethylsilanyloxy-acetonitrile2-phenyl-2-trimethylsilyloxyacetonitrileMFCD02295646Mandelonitrile, TMS derivative2-Phenyl-2-[(trimethylsilyl)oxy]acetonitrile (90%)C11H15NOSi2-(Trimethylsiloxy)-2-phenylacetonitrile
Show more names
Phenyl(trimethylsiloxy)acetonitrile(Trimethylsiloxy)phenylacetonitrilePhenyl(trimethylsilyloxy)acetonitrileα-(trimethylsilyloxy)phenylacetonitrileα-(Trimethylsilyloxy)phenylacetonitrileALPHA-(TRIMETHYLSILYLOXY)PHENYLACETONIT&α-[(Trimethylsilyl)oxy]benzeneacetonitrile2-(Trimethylsilyloxy)-2-phenylethanenitrileBenzeneacetonitrile, α-[(trimethylsilyl)oxy]-
alpha-(Trimethylsilyloxy)phenylacetonitrile2-phenyl-2-(trimethylsilyloxy)acetonitrileAcetonitrile, 2-phenyl-2-trimethylsilyloxy-o-trimethylsilylmandelonitrileSCHEMBL3295316DTXSID90345558AKOS011843931Phenyl[(trimethylsilyl)oxy]acetonitrile
Database identifiers
- CAS
25438-37-3- PubChem CID
- 605484
- DTXSID
DTXSID90345558- EC Number
- 624-871-7
- Nikkaji
- J344.715D
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 219
Physicochemical properties
- Boiling point
- 91 °C0.5 · 91 °C0.5 mm Hg(lit.)
- Density
- 0.978 g/mL · 0.978 g/mL at 25 °C(lit.)
- refractive index
- 0.978 · 0.978
- Flash point
- 221 °F · 221 °F
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- Benzene (Slightly), Chloroform (Sparingly), DMSO (Slightly), Methanol (Slightly)
- form
- Oil
- color
- Yellow
- Specific Gravity
- 0.978 · 0.978
- Hydrolytic Sensitivity
- 8 · 8: reacts rapidly with moisture, water, protic solvents
- Stability
- Moisture Sensitive
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 280 · P280
- Hazard Codes
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- tsca
- No
- risk_code
- 20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 23-27-36/37/39-45-7/9
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P280
Related reactions
4 records
Compound notes
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