Basic information
- CAS
1017-58-9- Standard SMILES
O=Cc1ccc(Sc2ccc(C=O)o2)o1- InChIKey
QOYKXSZOMMAGRQ-UHFFFAOYSA-N- Molecular formula
- C10H6O4S
- Average molar mass
- 222.22 g/mol
- Monoisotopic mass
- 221.99867984
Names & identifiers
- Preferred name
- 5,5'-Thiobis(2-furancarboxaldehyde)
- IUPAC
- 5-(5-formylfuran-2-yl)sulfanylfuran-2-carbaldehyde
- English name
- 2-Furancarboxaldehyde, 5,5'-thiobis-
- Molecular formula
- C10H6O4S
- Molecular weight
- 222.22
Names & synonyms
1017-58-95,5'-Thiobis(2-furancarboxaldehyde)5,5'-Thiobis[2-furancarboxaldehyde]RefChem:2981982-furancarboxaldehyde, 5,5'-thiobis-5-(5-Formylfuran-2-yl)sulfanylfuran-2-carbaldehyde2-FURANCARBOXALDEHYDE, 5,5/'-THIOBIS-5-[(5-FORMYLFURAN-2-YL)SULFANYL]FURAN-2-CARBALDEHYDE5-[(5-formyl-2-furyl)sulfanyl]-2-furaldehyde5,5'-Thiobis(furan-2-carbaldehyde)SCHEMBL18920930di(5-formylfuran-2-yl) sulfide
Show more names
5,5'-THIODI(2-FURALDEHYDE)
DTXSID501293346AKOS0225064975,5a(2)-Thiobis[2-furancarboxaldehyde]5,5'-Sulfanediyldi(furan-2-carbaldehyde)
Database identifiers
- CAS
1017-58-9- PubChem CID
- 12547826
- DTXSID
DTXSID501293346- Nikkaji
- J2.443.024C
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 85.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 222
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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