Basic information
- CAS
6512-83-0- Standard SMILES
O=C(O)c1ccccc1[Se][Se]c1ccccc1C(=O)O- InChIKey
KQOVQKHBCWQFCJ-UHFFFAOYSA-N- Molecular formula
- C14H10O4Se2
- Average molar mass
- 400.2 g/mol
- Monoisotopic mass
- 401.89095
Names & identifiers
- Preferred name
- 2,2'-Diselenobis(benzoic acid)
- IUPAC
- 2-[(2-carboxyphenyl)diselanyl]benzoic acid
- English name
- Bis(2-carboxyphenyl)diselenide
- Molecular formula
- C14H10O4Se2
- Molecular weight
- 400.15
Names & synonyms
6512-83-0BENZOIC ACID, 2,2'-DISELENOBIS-DTXSID00215435RefChem:10588962,2'-Diselenobis(benzoic acid)DTXCID00137926Bis(2-carboxyphenyl)diselenide2,2'-Diselanediyldibenzoic acid2-[(2-carboxyphenyl)diselanyl]benzoic acidCHEMBL1976884Diseleno salicylic acido,o'-Selenobis(benzoic acid)
Show more names
2,2'-Diselenobisbenzoic acid
2,2'-Selenobis(benzoic acid)Acide diselino salicylique [French]Acide diselino salicyliqueBRN 26253152,2'-diselenodibenzoic acid4-10-00-00314 (Beilstein Handbook Reference)SCHEMBL105215442,2'-Dicarboxy-diphenyl-diselenide
Database identifiers
- CAS
6512-83-0- PubChem CID
- 23012
- DTXSID
DTXSID00215435- ChEMBL
CHEMBL1976884- Nikkaji
- J87.207E
Properties
Computed structural properties
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 327
Physicochemical properties
- Melting point
- 297 °C · 297°C (rough estimate)
- Boiling point
- 585.7 · 585.7±60.0 °C(Predicted)
- pka
- 2.96 · 2.96±0.36(Predicted)
- form
- solid
Chemistry & industry
Suppliers5 total
上海健超生物科技有限公司15021035486 18081542813 · [email protected]
天津凯利奇生物科技有限公司15076683720 · [email protected]
南京安伦化工科技有限公司025-025-58367986 18913956109 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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