Basic information
- CAS
103314-75-6- Standard SMILES
CC1OC(C[N+](C)(C)C)CS1- InChIKey
NZAMMJKYTYHSHN-UHFFFAOYSA-N- Molecular formula
- C8H18NOS+
- Average molar mass
- 176.3 g/mol
- Monoisotopic mass
- 176.11091037
Overview
RN given for parent cpd without isomeric designation; structure given in first source
Names & identifiers
- Preferred name
- 2-Methyl-5-((dimethylamino)methyl)-1,3-oxathiolane methiodide
- IUPAC
- trimethyl-[(2-methyl-1,3-oxathiolan-5-yl)methyl]azanium
- English name
- 2-methyl-5-((dimethylamino)methyl)-1,3-oxathiolane methiodide
- Molecular weight
- 0
Names & synonyms
Mdmamot103314-75-62-Methyl-5-((dimethylamino)methyl)-1,3-oxathiolane methiodideRefChem:88163cis-Oxathiolane1,3-Oxathiolane-5-methanaminium, N,N,N,2-tetramethyl-CHEMBL1182266DTXSID30908323N,N,N-Trimethyl(2-methyl-1,3-oxathiolan-5-yl)methanaminium
Database identifiers
- CAS
103314-75-6- PubChem CID
- 4606
- DTXSID
DTXSID30908323- ChEMBL
CHEMBL1182266- Nikkaji
- J454.086G
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 1
- Complexity
- 133
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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