Basic information
- CAS
6319-42-2- Standard SMILES
CCCCCCCCCCSC(=NC)NC.I- InChIKey
BHFQPRLPQWBMBY-UHFFFAOYSA-N- Molecular formula
- C13H29IN2S
- Average molar mass
- 372.35 g/mol
- Monoisotopic mass
- 372.10962
Names & identifiers
- Preferred name
- Pseudourea, 2-decyl-1,3-dimethyl-2-thio-, hydriodide
- IUPAC
- decyl N,N'-dimethylcarbamimidothioate;hydroiodide
Names & synonyms
NSC 31045Pseudourea, 2-decyl-1,3-dimethyl-2-thio-, hydriodide6319-42-22-Decyl-1,3-dimethyl-2-thiopseudourea hydriodideDTXSID20212542Carbamimidothioic acid, N,N'-dimethyl-, decyl ester, monohydriodideRefChem:375771DTXCID50135033Carbamimidothioic acid, N,N'-dimethyl-, decyl ester, monohydriodide (9CI)NSC31045NSC-31045Decyl N,N'-dimethylcarbamimidothioate--hydrogen iodide (1/1)
Show more names
Carbamimidothioic acid,N'-dimethyl-, decyl ester, monohydriodide
Database identifiers
- CAS
6319-42-2- PubChem CID
- 80595
- DTXSID
DTXSID20212542
Properties
Computed structural properties
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 169
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…