Basic information
- CAS
51006-57-6- Standard SMILES
ClCCC[Si]12OCCN(CCO1)CCO2- InChIKey
ZWMZODRUDVNBOM-UHFFFAOYSA-N- Molecular formula
- C9H18ClNO3Si
- Average molar mass
- 251.78 g/mol
- Monoisotopic mass
- 251.0744477
Names & identifiers
- Preferred name
- 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3-chloropropyl)-
- IUPAC
- 1-(3-chloropropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Names & synonyms
NSC62654751006-57-62,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3-chloropropyl)-1-(3-Chloropropyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-(3-chloropropyl)-1-I(3)-ChloropropylsilatraneCHEMBL1990335SCHEMBL11724275DTXSID901990135-(3-chloropropyl)-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecaneNSC-626547NCI60_008399
Database identifiers
- CAS
51006-57-6- PubChem CID
- 142804
- DTXSID
DTXSID90199013- ChEMBL
CHEMBL1990335- EC Number
- 610-597-5
Properties
Computed structural properties
- Topological polar surface area
- 30.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 181
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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