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Diselenodi-n-valeric acid

HCID 313695
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Basic information

CAS
18285-95-5
Standard SMILES
O=C(O)CCCC[Se][Se]CCCCC(=O)O
InChIKey
OEBYCAORNOSTJH-UHFFFAOYSA-N
Molecular formula
C10H18O4Se2
Average molar mass
360.2 g/mol
Monoisotopic mass
361.95355

Names & identifiers

Preferred name
Diselenodi-n-valeric acid
IUPAC
5-(4-carboxybutyldiselanyl)pentanoic acid
English name
5,5'-Diselenodivaleric acid
Molecular formula
C10H18O4Se2
Molecular weight
360.17

Names & synonyms

Diselenodi-n-valeric acid18285-95-5Valeric acid, 5,5'-diselenodi-Pentanoic acid, 5,5'-diselenobis-RefChem:339102OEBYCAORNOSTJH-UHFFFAOYSA-NNSC2293405-(4-carboxybutyldiselanyl)pentanoic acid5,5/'-Diselenodivaleric aciddiselenodivaleric acidValeric acid,5'-diselenodi-Pentanoic acid,5'-diselenobis-
Show more names
5,5'-Diselenodivaleric acid5,5'-Diselenodipentanoic acidPentanoic acid, 5,5'-diselenobis- (9CI)
SCHEMBL22502524DTXSID00310611NSC-2293405,5'-(Diselane-1,2-diyl)dipentanoic acid

Database identifiers

CAS
18285-95-5
PubChem CID
313695
DTXSID
DTXSID00310611
Nikkaji
J122.234A

Properties

Computed structural properties

Topological polar surface area
74.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
16
Formal charge
0
Complexity
187

Physicochemical properties

Boiling point
521.7 · 521.7±60.0 °C(Predicted)
pka
4.39 · 4.39±0.10(Predicted)

Related reactions

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Compound notes

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