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Thiophene-2,5-dicarbaldehyde

PubChem CID: 587784

Connections displayed (default: 10).
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Compound Synonyms 2,5-Thiophenedicarboxaldehyde, Thiophene-2,5-dicarbaldehyde, 932-95-6, Thiophene-2,5-dicarboxaldehyde, 2,5-Diformylthiophene, 2,5-Thiophenedicarbaldehyde, DTXSID50343151, 2,5-THIOPHENENEDICARBOXALDEHYDE, 2,5-Thiophenedial, MFCD00216592, 2,5-Diformylthiophen, BIDD:GT0835, SCHEMBL178830, 2,5-thiophene dicarboxaldehyde, CHEMBL2229528, DTXCID10294231, AAA93295, BCP27894, 2,5-Thiophenedicarboxaldehyde, 99%, STL324623, XH0625, AKOS015855708, AC-5193, CS-W016463, AS-38473, DB-005145, EN300-624191, InChI=1/C6H4O2S/c7-3-5-1-2-6(4-8)9-5/h1-4, 627-004-0
Topological Polar Surface Area 62.4
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 9.0
Isotope Atom Count 0.0
Molecular Complexity 110.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name thiophene-2,5-dicarbaldehyde
Prediction Hob 1.0
Xlogp 1.2
Molecular Formula C6H4O2S
Prediction Swissadme 0.0
Inchi Key OTMRXENQDSQACG-UHFFFAOYSA-N
Fcsp3 0.0
Logs -2.146
Rotatable Bond Count 2.0
Logd 0.974
Compound Name Thiophene-2,5-dicarbaldehyde
Prediction Hob Swissadme 0.0
Exact Mass 139.993
Formal Charge 0.0
Monoisotopic Mass 139.993
Hydrogen Bond Acceptor Count 3.0
Molecular Weight 140.16
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -1.737821711111111
Inchi InChI=1S/C6H4O2S/c7-3-5-1-2-6(4-8)9-5/h1-4H
Smiles C1=C(SC(=C1)C=O)C=O
Nring 1.0
Defined Bond Stereocenter Count 0.0

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  • 2. Outgoing r'ship FOUND_IN to/from Atraphaxis Spinosa (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Bursaria Spinosa (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Capparis Angulata (Plant) Rel Props:Reference:
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  • 6. Outgoing r'ship FOUND_IN to/from Capparis Cartilaginea (Plant) Rel Props:Reference:
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  • 8. Outgoing r'ship FOUND_IN to/from Capparis Decidua (Plant) Rel Props:Reference:
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  • 10. Outgoing r'ship FOUND_IN to/from Capparis Divaricata (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Capparis Flavicans (Plant) Rel Props:Reference:
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  • 19. Outgoing r'ship FOUND_IN to/from Capparis Sepiaria (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Capparis Spinosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 21. Outgoing r'ship FOUND_IN to/from Capparis Zeylanica (Plant) Rel Props:Reference:
  • 22. Outgoing r'ship FOUND_IN to/from Catunaregam Spinosa (Plant) Rel Props:Reference:
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  • 30. Outgoing r'ship FOUND_IN to/from Lasia Spinosa (Plant) Rel Props:Reference:
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  • 42. Outgoing r'ship FOUND_IN to/from Vangueria Spinosa (Plant) Rel Props:Reference:
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  • 44. Outgoing r'ship FOUND_IN to/from Zilla Spinosa (Plant) Rel Props:Reference:
  • 45. Outgoing r'ship FOUND_IN to/from Ziziphus Jujuba (Plant) Rel Props:Reference: