Completing data — usually done within a minute
Basic information
- CAS
4743-21-9- Standard SMILES
C#Cc1ccc(-c2cccs2)s1- InChIKey
BJOAUTVUGMZMHI-UHFFFAOYSA-N- Molecular formula
- C10H6S2
- Average molar mass
- 190.3 g/mol
- Monoisotopic mass
- 189.99109219
Names & identifiers
- Preferred name
- 2,2'-Bithiophene, 5-ethynyl-
- IUPAC
- 2-ethynyl-5-thiophen-2-ylthiophene
Names & synonyms
5-Ethynyl-2,2'-bithiophene2,2'-Bithiophene, 5-ethynyl-4743-21-9DTXSID70197138RefChem:242228DTXCID801196295-Ethynyl-[2,2']bithiophenyl2-ethynyl-5-thiophen-2-ylthiopheneSCHEMBL8577680BJOAUTVUGMZMHI-UHFFFAOYSA-NAKOS0408157532-ethynyl-5-(thiophen-2-yl) thiophene
Show more names
A1-15192F2167-5120
Database identifiers
- CAS
4743-21-9- PubChem CID
- 6452092
- DTXSID
DTXSID70197138- Nikkaji
- J1.099.948K
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 203
Related reactions
4 records
Compound notes
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