Basic information
- CAS
852447-17-7- Standard SMILES
CC(C)(C)OC(=O)C(=O)[Si](C)(C)C(C)(C)C- InChIKey
GGYHTNUVBJRLDM-UHFFFAOYSA-N- Molecular formula
- C12H24O3Si
- Average molar mass
- 244.4 g/mol
- Monoisotopic mass
- 244.14947116
Names & identifiers
- Preferred name
- Tert-butyl 2-(tert-butyldimethylsilyl)-2-oxoacetate
- IUPAC
- tert-butyl 2-[tert-butyl(dimethyl)silyl]-2-oxoacetate
- English name
- tert-Butyl (tert-butyldimethylsilyl)glyoxylate
- Molecular formula
- C12H24O3Si
- Molecular weight
- 244.4
Names & synonyms
852447-17-7tert-butyl (tert-butyldimethylsilyl)glyoxylateTERT-BUTYL 2-(TERT-BUTYLDIMETHYLSILYL)-2-OXOACETATEC12H24O3SiSCHEMBL21327778CJB44717tert-Butyl (tert-butyldimethylsilyl)glyoxylate, 97%tert-butyl 2-[tert-butyl(dimethyl)silyl]-2-oxoacetatetert-butyl 2-[tert-butyl(dimethyl)silyl]-2-oxo-acetatetert-Butyl (tert-butyldimethylsilyl)glyoxylate 97%tert-Butyl(tert-butyldimethylsilyl)glyoxylate (95%)Acetic acid, 2-[(1,1-dimethylethyl)dimethylsilyl]-2-oxo-, 1,1-dimethylethyl ester
Database identifiers
- CAS
852447-17-7- PubChem CID
- 11622880
- EC Number
- 689-476-4
- Nikkaji
- J2.182.805J
Properties
Computed structural properties
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 292
Physicochemical properties
- Boiling point
- 263.7 · 263.7±23.0 °C(Predicted)
- Density
- 0.92 g/mL · 0.920 g/mL at 25 °C
- refractive index
- 20 · n20/D1.440
- Flash point
- 88 ℃ · 88℃
- form
- liquid
- InChI
- 1S/C12H24O3Si/c1-11(2,3)15-9(13)10(14)16(7,8)12(4,5)6/h1-8H3
- InChIKey
- GGYHTNUVBJRLDM-UHFFFAOYSA-N
- SMILES
- CC(C)(C)OC(=O)C(=O)[Si](C)(C)C(C)(C)C
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
- Xi
- Risk Statements
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 39 reports by companies from 2 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
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 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
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesLearn More at the Professor and Product Portal of Professor Jeffrey S. Johnson.
Suppliers4 total
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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