Completing data — usually done within a minute
Basic information
- CAS
2597-93-5- Standard SMILES
C[CH2][Hg][N]1C(=O)C2C(C1=O)C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl- InChIKey
HTCXJNNIWILFQQ-UHFFFAOYSA-M- Molecular formula
- C11H7Cl6HgNO2
- Average molar mass
- 598.5 g/mol
- Monoisotopic mass
- 596.831438
Names & identifiers
- Preferred name
- Ethyl(4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dionato-kappaN2)mercury
- IUPAC
- ethyl-(1,7,8,9,10,10-hexachloro-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)mercury
Names & synonyms
2597-93-5RefChem:200881Ethyl(4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dionato-kappaN2)mercury50-CS-46Mercury, ethyl(4,5,6,7,8,8-hexachloro-1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)-ethyl-(1,7,8,9,10,10-hexachloro-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)mercuryMercury, ethyl(4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dionato-.kappa.N2)-Ethylmercury(1+);1,7,8,9,10,10-hexachloro-5-oxo-4-azatricyclo[5.2.1.02,6]deca-3,8-dien-3-olateSCHEMBL5933970NSC22200Tox21_303854AKOS024429069
Show more names
NCGC00357007-01CAS-2597-93-5NS001220685-Norbornene-2, 1,4,5,6,7,7-hexachloro-N-(ethylmercuri)-WLN: T C555 A DVNV IUTJ AG AG BG E-HG-2 HG IG JGMercury,4,5,6,7,7-hexachloro-5-norbornene-2,3-dicarboximidato)-Mercury, ethyl(1,4,5,6,7,7-hexachloro-5-norbornene-2,3,-dicarboximido)4,3(2H)-dione, 4,5,6,7,8,8-hexachloro-2-(ethylmercurio)-3a,4,7,7a-tetrahydro-
Database identifiers
- CAS
2597-93-5- PubChem CID
- 17437
- DTXSID
DTXSID7044558
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 564
Related reactions
1 records
Compound notes
Loading…