5-Chloro-4-nitro-1,2-dihydroacenaphthylene
Basic information
- CAS
104036-78-4- Standard SMILES
O=[N+]([O-])c1cc2c3c(cccc3c1Cl)CC2- InChIKey
BIAGLVOSHCXSQV-UHFFFAOYSA-N- Molecular formula
- C12H8ClNO2
- Average molar mass
- 233.65 g/mol
- Monoisotopic mass
- 233.0243562
Names & identifiers
- Preferred name
- 5-Chloro-4-nitro-1,2-dihydroacenaphthylene
- IUPAC
- 5-chloro-4-nitro-1,2-dihydroacenaphthylene
- English name
- 5-Chloro-4-nitro-1,2-dihydroacenaphthylene
- Molecular formula
- C12H8ClNO2
- Molecular weight
- 233.65
Names & synonyms
5-chloro-4-nitro-1,2-dihydroacenaphthylene104036-78-45-Chloro-1,2-dihydro-4-nitroacenaphthylene5-chloro-4-nitroacenaphtheneSCHEMBL11422842DTXSID901267911SBB098137AQ-344/43099973Acenaphthylene, 5-chloro-1,2-dihydro-4-nitro-
Database identifiers
- CAS
104036-78-4- PubChem CID
- 820798
- DTXSID
DTXSID901267911
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 304
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…