Isopropylamine, 2-thienyl-, sulfate
Basic information
- CAS
63905-61-3- Standard SMILES
CC(C)([NH3+])c1cccs1.O=S(=O)([O-])O- InChIKey
MBGQFZSCSZWCQS-UHFFFAOYSA-N- Molecular formula
- C7H13NO4S2
- Average molar mass
- 239.3 g/mol
- Monoisotopic mass
- 239.02860024
Names & identifiers
- Preferred name
- Isopropylamine, 2-thienyl-, sulfate
- IUPAC
- hydrogen sulfate;2-thiophen-2-ylpropan-2-ylazanium
Names & synonyms
ISOPROPYLAMINE, 2-THIENYL-, SULFATEbeta-(2-Thienyl)isopropylamine sulfate63905-61-3DTXSID50213547RefChem:349835DTXCID801360382-(thiophen-2-yl)propan-2-aminium hydrogen sulfate
Database identifiers
- CAS
63905-61-3- PubChem CID
- 45098
- DTXSID
DTXSID50213547
Properties
Computed structural properties
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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