Basic information
- CAS
105029-47-8- Standard SMILES
CC(C)(C)NCCCOc1cccc(OCCCNC(C)(C)C)c1.CI.CI- InChIKey
NLPDTVSIJWOPFA-UHFFFAOYSA-N- Molecular formula
- C22H42I2N2O2
- Average molar mass
- 620.4 g/mol
- Monoisotopic mass
- 620.13357
Overview
RN given for iodomethane [1:2] compd
Names & identifiers
- Preferred name
- 1,3-Bis(3-tert-butylamino-1-propoxy)benzene dimethiodide
- IUPAC
- N-[3-[3-[3-(tert-butylamino)propoxy]phenoxy]propyl]-2-methylpropan-2-amine;iodomethane
Names & synonyms
105029-47-8Compound-79-2971,3-Bis(3-tert-butylamino-1-propoxy)benzene dimethiodideRefChem:725061,3-Bis(3-t-butylamino-1-propoxy)benzene dimethiodideCompound 79297Compound 79-297Propylamine, 3,3'-(m-phenylenedioxy)bis(N-tert-butyl-, dimethiodideDTXSID20909309N-[3-[3-[3-(tert-butylamino)propoxy]phenoxy]propyl]-2-methylpropan-2-amine;iodomethane3,3'-[1,3-Phenylenebis(oxy)]bis(N-tert-butylpropan-1-amine)--iodomethane (1/2)
Database identifiers
- CAS
105029-47-8- PubChem CID
- 175994
- DTXSID
DTXSID20909309
Properties
Computed structural properties
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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