2-Methyl-5-tridecylthiophene
Basic information
- CAS
107370-30-9- Standard SMILES
CCCCCCCCCCCCCc1ccc(C)s1- InChIKey
QELIGOTUMMUMBZ-UHFFFAOYSA-N- Molecular formula
- C18H32S
- Average molar mass
- 280.5 g/mol
- Monoisotopic mass
- 280.22247219
Names & identifiers
- Preferred name
- 2-Methyl-5-tridecylthiophene
- IUPAC
- 2-methyl-5-tridecylthiophene
Names & synonyms
2-Methyl-5-tridecylthiophene107370-30-9DTXSID30335559RefChem:263573DTXCID80286648QELIGOTUMMUMBZ-UHFFFAOYSA-NThiophene, 2-methyl-5-tridecyl
Database identifiers
- CAS
107370-30-9- PubChem CID
- 525985
- DTXSID
DTXSID30335559
Properties
Computed structural properties
- XLogP
- 8.6
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 12
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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