1,1,5,6-tetramethyl-2,3-dihydro-1H-indene
PubChem CID: 523106
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| Compound Synonyms | 1,1,5,6-Tetramethylindane, 1,1,5,6-TETRAMETHYLINDAN, 1,1,5,6-tetramethyl-2,3-dihydro-1H-indene, 1H-Indene, 2,3-dihydro-1,1,5,6-tetramethyl-, 2,3-Dihydro-1,1,5,6-tetramethyl-1H-indene, 1,1,5,6-Tetramethylindane #, SOVJMXNIZUPIFE-UHFFFAOYSA-N, AKOS006295178, 942-43-8, EN300-8090079, 885-938-6 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 13.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 192.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 3,3,5,6-tetramethyl-1,2-dihydroindene |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | 4.4 |
| Is Pains | False |
| Molecular Formula | C13H18 |
| Prediction Swissadme | 0.0 |
| Inchi Key | SOVJMXNIZUPIFE-UHFFFAOYSA-N |
| Fcsp3 | 0.5384615384615384 |
| Rotatable Bond Count | 0.0 |
| Compound Name | 1,1,5,6-tetramethyl-2,3-dihydro-1H-indene |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 174.141 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 174.141 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 174.28 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.008917861538462 |
| Inchi | InChI=1S/C13H18/c1-9-7-11-5-6-13(3,4)12(11)8-10(9)2/h7-8H,5-6H2,1-4H3 |
| Smiles | CC1=CC2=C(C=C1C)C(CC2)(C)C |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Nerium Oleander (Plant) Rel Props:Source_db:cmaup_ingredients