1,2,3,4,16,17,18-Heptachlorodiacenaphtho[1,2-j:1',2'-l]fluoranthene
Basic information
- CAS
85168-81-6- Standard SMILES
Clc1c(Cl)c2cccc3c2c(c1Cl)c1c3c2c3cccc4cccc(c43)c2c2c3ccc(Cl)c4c(Cl)c(Cl)c(Cl)c(c43)c21- InChIKey
DJCVAQYPLYIBJI-UHFFFAOYSA-N- Molecular formula
- C36H11Cl7
- Average molar mass
- 691.6 g/mol
- Monoisotopic mass
- 687.868044
Names & identifiers
- Preferred name
- 1,2,3,4,16,17,18-Heptachlorodiacenaphtho[1,2-j:1',2'-l]fluoranthene
- IUPAC
- 5,6,7,9,31,32,33-heptachlorodecacyclo[24.7.1.14,8.115,19.02,25.03,13.014,24.030,34.012,36.023,35]hexatriaconta-1(33),2(25),3(13),4,6,8,10,12(36),14(24),15,17,19(35),20,22,26(34),27,29,31-octadecaene
- English name
- heptachlorodiacenaphtho[1,2-j:1',2'-l]fluoranthene
- Molecular formula
- C36H11Cl7
- Molecular weight
- 691.64354
Names & synonyms
DJCVAQYPLYIBJI-UHFFFAOYSA-NDTXSID4010056111,2,3,4,16,17,18-Heptachlorodiacenaphtho[1,2-j:1',2'-l]fluorantheneEinecs 285-922-3heptachlorodiacenaphtho[1,2-j:1',2'-l]fluoranthene
Database identifiers
- CAS
85168-81-6- PubChem CID
- 57354501
- DTXSID
DTXSID401005611
Properties
Computed structural properties
- XLogP
- 14.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,130
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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