4-(tert-Butyldimethylsilyloxy)cyclohexanone - CAS 55145-45-4
Catalog: |
BB028922 |
Product Name: |
4-(tert-Butyldimethylsilyloxy)cyclohexanone |
CAS: |
55145-45-4 |
Synonyms: |
4-[tert-butyl(dimethyl)silyl]oxycyclohexan-1-one |
IUPAC Name: | 4-[tert-butyl(dimethyl)silyl]oxycyclohexan-1-one |
Description: | 4-(tert-Butyldimethylsilyloxy)cyclohexanone (CAS# 55145-45-4) is a useful research chemical. |
Molecular Weight: | 228.40 |
Molecular Formula: | C12H24O2Si |
Canonical SMILES: | CC(C)(C)[Si](C)(C)OC1CCC(=O)CC1 |
InChI: | InChI=1S/C12H24O2Si/c1-12(2,3)15(4,5)14-11-8-6-10(13)7-9-11/h11H,6-9H2,1-5H3 |
InChI Key: | HXKBGMNGSYGPRB-UHFFFAOYSA-N |
Boiling Point: | 85 ℃1 mmHg (lit.) |
Purity: | 95 % |
Density: | 0.909 g/cm3 |
Appearance: | Colorless to yellow liquid |
MDL: | MFCD06411307 |
LogP: | 3.51990 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020180768-A1 | Bicyclic heteroaryl compounds and uses thereof | 20190301 |
US-2020095240-A1 | Aminopyrimidine compound | 20180925 |
EP-3856188-A1 | Aminopyrimidine compound | 20180925 |
KR-20210082454-A | aminopyrimidine compounds | 20180925 |
US-11130752-B2 | Aminopyrimidine compound | 20180925 |
PMID | Publication Date | Title | Journal |
18095699 | 20080117 | A convergent synthesis of the tricyclic core of the dictyosphaeric acids | Organic letters |
16808527 | 20060707 | Enantioselective synthesis of a key 'A-ring' intermediate for the preparation of 1alpha-fluoro vitamin D3 analogues | The Journal of organic chemistry |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.154556538 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.154556538 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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