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Catalog Number | ACM26516518 |
CAS Number | 26516-51-8 |
Structure | ![]() |
Synonyms | Solanthrene |
Molecular Weight | 379.6 |
InChI | InChI=1S/C27H41N/c1-17-8-11-23-18(2)25-24(28(23)16-17)15-22-20-10-9-19-7-5-6-13-26(19,3)21(20)12-14-27(22,25)4/h5,7,9,17-18,20-25H,6,8,10-16H2,1-4H3/t17-,18+,20+,21-,22-,23+,24-,25-,26-,27-/m0/s1 |
InChI Key | MVUKDQDMGIMFPT-LTLBHDAASA-N |
Purity | 90%+ |
Complexity | 720 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 10 |
Exact Mass | 379.323900312 |
Heavy Atom Count | 28 |
Hydrogen Bond Acceptor Count | 1 |
Hydrogen Bond Donor Count | 0 |
Isomeric SMILES | C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CCC=C6)C)C)C |
Monoisotopic Mass | 379.323900312 |
PhysicalState | Powder |
Rotatable Bond Count | 0 |
Topological Polar Surface Area | 3.2 Ų |
What is another name for Solanthrene?
Solanidiene
What is the molecular formula for Solanthrene?
C27H41N
What is the molecular weight of Solanthrene?
379.62
What is the melting point of Solanthrene?
167 °C
What is the predicted boiling point of Solanthrene?
480.1±44.0 °C
What is the predicted density of Solanthrene?
1.06±0.1 g/cm3
What is the predicted pka value of Solanthrene?
11.62±0.70
How can Solanthrene also be represented chemically?
Solanida-3,5-diene
What is the CAS number for Solanthrene?
26516-51-8
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