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Catalog Number | ACM5932536-2 |
CAS Number | 5932-53-6 |
Synonyms | (1R,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-one;(1R,5R,6S)-rel-6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-one;(1R,5R,8R)-6beta-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-one;5932-53-6;6-BETA-HYDROXYTROPINONE;6-Hydroxytropinone;6-hydroxy tropinone;6b-hydroxytropan-3-one;7-Hydroxy-8-methylazabicyclo(3.2.1)octan-3-one |
IUPAC Name | (1R,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-one. |
Molecular Weight | 155.1943g/mol |
Molecular Formula | C8H13NO2 |
InChI | InChI=1S/C8H13NO2/c1-9-5-2-6(10)4-7(9)8(11)3-5/h5,7-8,11H,2-4H2,1H3/t5-,7+,8-/m0/s1 |
InChI Key | UOHSTKWPZWFYTF-ARDNSNSESA-N |
Boiling Point | 291.6°C at 760mmHg |
Melting Point | 120-121°C(Lit.) |
Flash Point | 130.1°C |
Purity | 0.95 |
Density | at 20°C 1.217g/cm³ |
Appearance | Light yellow to Yellow to Orange powder to crystal |
Storage | Refrigerated (2-8°C) |
Complexity | 193 |
Covalently-Bonded Unit Count | 1 |
Defined Atom Stereocenter Count | 3 |
Defined Bond Stereocenter Count | 0 |
Degree Of Certification | 6beta-Hydroxytropinone reference substance is a primary reference standard with certified absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). |
EC Number | 227-677-7 |
Exact Mass | 155.095g/mol |
Formal Charge | 0 |
Hazard Statements | H302: Harmful if swallowed. H315: Causes skin irritation. H319: Causes serious eye irritation. H335: May cause respiratory irritation.P261: Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP]. P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do. Continue rinsing. |
Heavy Atom Count | 11 |
HS Code | 29397990 |
Hydrogen Bond Acceptor Count | 3 |
Hydrogen Bond Donor Count | 1 |
Isotope Atom Count | 0 |
MDL Number | MFCD00135648 |
Monoisotopic Mass | 155.095g/mol |
Rotatable Bond Count | 0 |
Topological Polar Surface Area | 40.5A^2. |
Undefined Atom Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
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