Basic information
- CAS
6963-02-6- Standard SMILES
COC(CI)C(CI)OC- InChIKey
XKAANJFSVANRGV-UHFFFAOYSA-N- Molecular formula
- C6H12I2O2
- Average molar mass
- 369.97 g/mol
- Monoisotopic mass
- 369.89267
Names & identifiers
- Preferred name
- 1,4-Diiodo-2,3-dimethoxybutane
- IUPAC
- 1,4-diiodo-2,3-dimethoxybutane
Names & synonyms
1,4-Diiodo-2,3-dimethoxybutane6963-02-6DTXSID10989736RefChem:1053283DTXCID301416851Butane, 1,4-diiodo-2,3-dimethoxy-NSC53706SCHEMBL117608281,4-diiodo-2,3-dimethoxy-butaneNSC 53706NSC-53706
Database identifiers
- CAS
6963-02-6- PubChem CID
- 97878
- DTXSID
DTXSID10989736- Nikkaji
- J1.555.640D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 70.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…