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14387-28-1 | Benzoic acid, 4,4'-selenobis- (9CI)
CAS No: 14387-28-1 Catalog No: AG001IIF MDL No:
Product Description
Catalog Number:
AG001IIF
Chemical Name:
Benzoic acid, 4,4'-selenobis- (9CI)
CAS Number:
14387-28-1
Molecular Formula:
C14H10O4Se
Molecular Weight:
321.1868
IUPAC Name:
4-(4-carboxyphenyl)selanylbenzoic acid
InChI:
InChI=1S/C14H10O4Se/c15-13(16)9-1-5-11(6-2-9)19-12-7-3-10(4-8-12)14(17)18/h1-8H,(H,15,16)(H,17,18)
InChI Key:
SXPYGTTXCSTFLR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)[Se]c1ccc(cc1)C(=O)O
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.974g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
321.201g/mol
Monoisotopic Mass:
321.974g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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