1,1'3,3',5,5'6,6'-Octamethyl-2,2'-spiro(2,3-dihydro-1H-benzimidazole
Basic information
- CAS
99643-38-6- Standard SMILES
Cc1cc2c(cc1C)N(C)C1(N2C)N(C)c2cc(C)c(C)cc2N1C- InChIKey
MTFYBWKFOIZUKS-UHFFFAOYSA-N- Molecular formula
- C21H28N4
- Average molar mass
- 336.5 g/mol
- Monoisotopic mass
- 336.23139691
Names & identifiers
- Preferred name
- 1,1'3,3',5,5'6,6'-Octamethyl-2,2'-spiro(2,3-dihydro-1H-benzimidazole
- IUPAC
- 1,1',3,3',5,5',6,6'-octamethyl-2,2'-spirobi[benzimidazole]
- English name
- 1,13,3,5,56,6-Octamethyl-2,2-spiro(2,3-dihydro-1H-benzimidazole
- Molecular formula
- C21H28N4
- Molecular weight
- 336.47
Names & synonyms
99643-38-61,1'3,3',5,5'6,6'-Octamethyl-2,2'-spiro(2,3-dihydro-1H-benzimidazole1,1'3,3',5,5'6,6'-Octamethyl-2,2'-spiro[2,3-dihydro-1H-benzimidazoleRefChem:2124611,1',3,3',5,5',6,6'-octamethyl-2,2'-spirobi[benzimidazole]1,1',3,3',5,5',6,6'-octamethyl-1,1',3,3'-tetrahydro-2,2'-spirobi[benzo[d]imidazole]DTXSID10912569AKOS0329603771,1',3,3',5,5',6,6'-Octamethyl-1,1',3,3'-tetrahydro-2,2'-spirobi[[1,3]benzimidazole]1,1',3,3',5,5',6,6'-Octamethyl-1,1',3,3'-tetrahydro-2,2'-spirobi[benzimidazole]4S Green Nucleic Acid Stain4S Green Nucleic Acid Stain 4S Green
Show more names
1,13,3,5,56,6-Octamethyl-2,2-spiro(2,3-dihydro-1H-benzimidaz1,13,3,5,56,6-Octamethyl-2,2-spiro(2,3-dihydro-1H-benzimidazole1,1',3,3',5,5',6,6'-octaMethyl-2,2'-spirobi2,2'-Spirobi[2H-benzimidazole], 1,1',3,3'-tetrahydro-1,1',3,3',5,5',6,6'-octamethyl-
Database identifiers
- CAS
99643-38-6- PubChem CID
- 145343
- DTXSID
DTXSID10912569- EC Number
- 805-243-3
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 13 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 429
Physicochemical properties
- Boiling point
- 537.2 · 537.2±50.0 °C(Predicted)
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 2.81 · 2.81±0.20(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesNot Classified
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…