2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
Basic information
- CAS
101198-12-3- Standard SMILES
CC(COc1ccccc1)C(=O)OCCN1CCO[Si](C)(C)OCC1- InChIKey
ZIIDHPAOCIOQJO-UHFFFAOYSA-N- Molecular formula
- C18H29NO5Si
- Average molar mass
- 367.5 g/mol
- Monoisotopic mass
- 367.18149956
Names & identifiers
- Preferred name
- 2-(2,2-Dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
- IUPAC
- 2-(2,2-dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoate
Names & synonyms
101198-12-3DTXSID709059722-(2,2-dimethyl-1,3,6,2-dioxazasilocan-6-yl)ethyl 2-methyl-3-phenoxypropanoateRefChem:1060713DTXCID9013350732,2-Dimethyl-1,3-dioxa-6-aza-2-silacyclooctane-6-ethanol 2-methyl-3-phenoxypropionate1,3-Dioxa-6-aza-2-silacyclooctane-6-ethanol, 2,2-dimethyl-, 2-methyl-3-phenoxypropionate
Database identifiers
- CAS
101198-12-3- PubChem CID
- 58200
- DTXSID
DTXSID70905972- Nikkaji
- J69.166F
Properties
Computed structural properties
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 389
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Compound notes
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