Basic information
- CAS
42402-56-2- Standard SMILES
O=NC1C(Cl)C2CC1C1C=CCC12- InChIKey
YKPBRMJPNZXKRN-UHFFFAOYSA-N- Molecular formula
- C10H12ClNO
- Average molar mass
- 197.66 g/mol
- Monoisotopic mass
- 197.0607417
Names & identifiers
- Preferred name
- 6-Chloro-5-nitroso-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene
- IUPAC
- 8-chloro-9-nitrosotricyclo[5.2.1.02,6]dec-3-ene
Names & synonyms
6319-12-642402-56-26-chloro-5-nitroso-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene4, 6-chloro-3a,4,5,6,7,7a-hexahydro-5-nitroso-, dimerNSC32002DTXSID80979189NSC31986NSC32003NSC-31986NSC-32002NSC-320034, 5-nitroso-3a,4,5,6,7,7a-hexahydro-6-chloro-, dimer
Database identifiers
- CAS
42402-56-2、6319-12-6- PubChem CID
- 233458
- DTXSID
DTXSID80979189
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 29.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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