Spiro(thiazolidine-2,2'-tricyclo(3.3.1.1(sup 3,7))decane)-5'-carboxylic acid, hydrochloride
Basic information
- CAS
159553-32-9- Standard SMILES
Cl.O=C(O)C12CC3CC(C1)C1(NCCS1)C(C3)C2- InChIKey
UCTRUENATJUSRM-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO2S
- Average molar mass
- 289.82 g/mol
- Monoisotopic mass
- 289.0903277
Names & identifiers
- Preferred name
- Spiro(thiazolidine-2,2'-tricyclo(3.3.1.1(sup 3,7))decane)-5'-carboxylic acid, hydrochloride
- IUPAC
- spiro[1,3-thiazolidine-2,4'-adamantane]-1'-carboxylic acid;hydrochloride
Names & synonyms
Spiro(thiazolidine-2,2'-tricyclo(3.3.1.1(sup 3,7))decane)-5'-carboxylic acid, hydrochloride159553-32-9RefChem:381231DTXSID50936123Spiro[[1,3]thiazolidine-2,2'-tricyclo[3.3.1.1~3,7~]decane]-5'-carboxylic acid--hydrogen chloride (1/1)Spiro[1,3-thiazolidine-2,2'-tricyclo[3.3.1.1~3,7~]decane]-5'-carboxylic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
159553-32-9- PubChem CID
- 3074569
- DTXSID
DTXSID50936123
Properties
Computed structural properties
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 368
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Compound notes
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