Bis(2-chloroethyl) 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
Basic information
- CAS
7256-35-1- Standard SMILES
O=C(OCCCl)C1C(C(=O)OCCCl)C2(Cl)C(Cl)=C(Cl)C1(Cl)C2(Cl)Cl- InChIKey
NBCFJWKXFMPJRU-UHFFFAOYSA-N- Molecular formula
- C13H10Cl8O4
- Average molar mass
- 513.8 g/mol
- Monoisotopic mass
- 509.80873
Names & identifiers
- Preferred name
- Bis(2-chloroethyl) 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
- IUPAC
- bis(2-chloroethyl) 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate
Names & synonyms
7256-35-1bis(2-chloroethyl) 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylateNSC22212DTXSID30993416NSC-22212
Database identifiers
- CAS
7256-35-1- PubChem CID
- 228949
- DTXSID
DTXSID30993416
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 573
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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