Acetamidine, N,N-dimethyl-2-(thymyloxy)-, monohydrochloride
Basic information
- CAS
20290-28-2- Standard SMILES
CC(C)c1ccc(COCC(N)=[N+](C)C)cc1.[Cl-]- InChIKey
OKBFCOHJPXQZTL-UHFFFAOYSA-N- Molecular formula
- C14H23ClN2O
- Average molar mass
- 270.8 g/mol
- Monoisotopic mass
- 270.1498911
Names & identifiers
- Preferred name
- Acetamidine, N,N-dimethyl-2-(thymyloxy)-, monohydrochloride
- IUPAC
- [1-amino-2-[(4-propan-2-ylphenyl)methoxy]ethylidene]-dimethylazanium chloride
Names & synonyms
SU-198 hydrochlorideN,N-Dimethylthymyloxyacetamidine hydrochlorideEthanimidamide, N,N-dimethyl-2-(5-methyl-2-(1-methylethyl)phenoxy)-, monohydrochlorideACETAMIDINE, N,N-DIMETHYL-2-(THYMYLOXY)-, MONOHYDROCHLORIDE20290-28-2RefChem:315643
Database identifiers
- CAS
20290-28-2- PubChem CID
- 30095
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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