Dimethylthiambutene hydrochloride
Basic information
- CAS
5786-77-6- Standard SMILES
CC(C=C(c1cccs1)c1cccs1)[NH+](C)C.[Cl-]- InChIKey
OBFGNODOJKVYIR-UHFFFAOYSA-N- Molecular formula
- C14H18ClNS2
- Average molar mass
- 299.9 g/mol
- Monoisotopic mass
- 299.0569196
Names & identifiers
- Preferred name
- Dimethylthiambutene hydrochloride
- IUPAC
- 4,4-dithiophen-2-ylbut-3-en-2-yl(dimethyl)azanium chloride
Names & synonyms
Dimethylthiambutene hydrochlorideOhton hydrochloride5786-77-63-Buten-2-amine, N,N-dimethyl-4,4-di-2-thienyl-, hydrochlorideZI2995I73YRefChem:1083727Dimethylthiambutene HClUNII-ZI2995I73Y3,3-Di-2-thienyl-N,N,1-trimethylallylamine hydrochlorideAminobutene hydrochlorideDimethibutin hydrochlorideALLYLAMINE, 3,3-DI-2-THIENYL-N,N,1-TRIMETHYL-, HYDROCHLORIDE
Show more names
FD22411N,N-Dimethyl-4,4-di-2-thienyl-3-buten-2-amine hydrochloride
Database identifiers
- CAS
5786-77-6- PubChem CID
- 22028
Properties
Computed structural properties
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 257
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Compound notes
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