Basic information
- CAS
158069-32-0- Standard SMILES
C=CC(CCCOS(=O)(=O)c1ccc(NC(C)=O)cc1)[Si](C)(C)c1ccccc1- InChIKey
ZBWRCWQYARWQCU-UHFFFAOYSA-N- Molecular formula
- C22H29NO4SSi
- Average molar mass
- 431.6 g/mol
- Monoisotopic mass
- 431.15865611
Names & identifiers
- Preferred name
- 4-(Dimethylphenylsilyl)-5-hexenyl 4-(acetylamino)benzenesulfonate
- IUPAC
- 4-[dimethyl(phenyl)silyl]hex-5-enyl 4-acetamidobenzenesulfonate
- English name
- 4'-dimethylphenylsilyl-1'-hexen-6'-yl 4-(acetylamino)benzenesulfonate
- Molecular formula
- C22H29NO4SSi
- Molecular weight
- 431.62046
Names & synonyms
161717-97-14-(Dimethylphenylsilyl)-5-hexenyl 4-(acetylamino)benzenesulfonate4'-Dmpsh 4-acnbs158069-32-04-[dimethyl(phenyl)silyl]hex-5-enyl 4-acetamidobenzenesulfonateDTXSID509358534'-Dimethylphenylsilyl-1'-hexen-6'-yl 4-(acetylamino)benzenesulfonateBenzenesulfonic acid, 4-(acetylamino)-, 4-(dimethylphenylsilyl)-5-hexenyl esterN-{4-[({4-[Dimethyl(phenyl)silyl]hex-5-en-1-yl}oxy)sulfonyl]phenyl}ethanimidato(2-)N-{4-[({4-[Dimethyl(phenyl)silyl]hex-5-en-1-yl}oxy)sulfonyl]phenyl}ethanimidic acid
Database identifiers
- CAS
158069-32-0、161717-97-1- PubChem CID
- 190909
- DTXSID
DTXSID50935853- Nikkaji
- J664.786C
Properties
Computed structural properties
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 630
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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