Benzoic acid, 4-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yloxy)-, methyl ester
Basic information
- CAS
61442-40-8- Standard SMILES
COC(=O)c1ccc(O[Si]23OCCN(CCO2)CCO3)cc1- InChIKey
PZCMIPXUEBAZAS-UHFFFAOYSA-N- Molecular formula
- C14H19NO6Si
- Average molar mass
- 325.39 g/mol
- Monoisotopic mass
- 325.09816386
Names & identifiers
- Preferred name
- Benzoic acid, 4-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yloxy)-, methyl ester
- IUPAC
- methyl 4-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-yloxy)benzoate
Names & synonyms
BRN 29021621-(p-Karbometoksyfenoksy)silatranu [Polish]1-(p-Karbometoksyfenoksy)silatranuBenzoic acid, 4-(2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undec-1-yloxy)-, methyl ester61442-40-8DTXSID602103854-(2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undec-1-yloxy)benzoic acid methyl esterBenzoic acid, 4-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yloxy)-, methyl esterRefChem:118428DTXCID60132876Methyl 4-[(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-yl)oxy]benzoate
Database identifiers
- CAS
61442-40-8- PubChem CID
- 43654
- DTXSID
DTXSID60210385
Properties
Computed structural properties
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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