Phenanthro(9,10-b)thiophene
Basic information
- CAS
236-01-1- Standard SMILES
c1ccc2c(c1)c1ccccc1c1sccc21- InChIKey
OGOOBRWCZLKZSV-UHFFFAOYSA-N- Molecular formula
- C16H10S
- Average molar mass
- 234.3 g/mol
- Monoisotopic mass
- 234.05032149
Names & identifiers
- Preferred name
- Phenanthro(9,10-b)thiophene
- IUPAC
- phenanthro[9,10-b]thiophene
Names & synonyms
Phenanthro[9,10-b]thiophene236-01-1Phenanthro(9,10-b)thiopheneDTXSID10946420RefChem:368601DTXCID801374707OGOOBRWCZLKZSV-UHFFFAOYSA-NSCHEMBL14603345AM-944/40948092
Database identifiers
- CAS
236-01-1- PubChem CID
- 164572
- DTXSID
DTXSID10946420- Nikkaji
- J1.272.911A
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 287
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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