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Catalog Number | ACM68473858 |
CAS Number | 68473-85-8 |
Synonyms | (2R,3S)-2,3-Dihydroxy-2-isopropylbutanoic acid [(1R,7aS)-hexahydro-1H-pyrrolizin-1-yl]methyl ester |
Molecular Weight | 285.38 |
InChI | InChI=1S/C15H27NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11-,12-,13-,15+/m0/s1 |
InChI Key | BWQSLRZZOVFVHJ-PWNZVWSESA-N |
Purity | 95%+ |
Complexity | 360 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 4 |
Exact Mass | 285.19400834 |
Heavy Atom Count | 20 |
Hydrogen Bond Acceptor Count | 5 |
Hydrogen Bond Donor Count | 2 |
Isomeric SMILES | C[C@@H]([C@](C(C)C)(C(=O)OC[C@@H]1CCN2[C@H]1CCC2)O)O |
Monoisotopic Mass | 285.19400834 |
PhysicalState | Powder |
Rotatable Bond Count | 6 |
Topological Polar Surface Area | 70 Ų |
What is the chemical name of the compound with the synonym Heliovicine?
The chemical name is (2R,3S)-2,3-Dihydroxy-2-isopropylbutanoic acid [(1R,7aS)-hexahydro-1H-pyrrolizin-1-yl]methyl ester.
What is the CAS number of Heliovicine?
The CAS number is 68473-85-8.
What is the molecular formula of Heliovicine?
The molecular formula is C15H27NO4.
What is the molecular weight of Heliovicine?
The molecular weight is 285.38.
What is the predicted boiling point of Heliovicine?
The predicted boiling point is 413.5±14.0 °C.
What is the predicted density of Heliovicine?
The predicted density is 1.16±0.1 g/cm3.
What is the predicted pka value of Heliovicine?
The predicted pka value is 12.61±0.29.
What are some synonyms of Heliovicine?
Some synonyms include Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, and (2R,3S)-.
What are the stereochemistry configurations of Heliovicine?
The stereochemistry configurations are (2R,3S) and [(1R,7aS)].
How can Heliovicine be described based on its chemical properties?
Heliovicine can be described as a compound with specific boiling point, density, and pka value, as well as a certain molecular formula and weight.
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