Methyl 3-(azetidine-3-sulfonyl)propanoate hydrochloride
Basic information
- CAS
1823885-29-5- Standard SMILES
COC(=O)CCS(=O)(=O)C1CNC1.Cl- InChIKey
WDRWMUPFBDKHKN-UHFFFAOYSA-N- Molecular formula
- C7H14ClNO4S
- Average molar mass
- 243.71 g/mol
- Monoisotopic mass
- 243.0332068
Names & identifiers
- Preferred name
- Methyl 3-(azetidine-3-sulfonyl)propanoate hydrochloride
- IUPAC
- methyl 3-(azetidin-3-ylsulfonyl)propanoate;hydrochloride
Names & synonyms
methyl 3-(azetidine-3-sulfonyl)propanoate hydrochloride1823885-29-5methyl 3-(azetidin-3-ylsulfonyl)propanoate;hydrochlorideAKOS026746696EN300-241338methyl3-(azetidine-3-sulfonyl)propanoatehydrochlorideF2167-0224Methyl 3-(azetidin-3-ylsulfonyl)propanoate hydrochloride
Database identifiers
- CAS
1823885-29-5- PubChem CID
- 72716319
- EC Number
- 190-547-2
Properties
Computed structural properties
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 275
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Related reactions
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Compound notes
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