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Scopoline

Catalog Number
ACM487274-1
Product Name
Scopoline
Structure
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CAS
487-27-4
  • Product Overview
Synonyms
Oscine
IUPAC Name
Scopoline
Molecular Weight
155.19
Molecular Formula
C8H13NO2
Canonical SMILES
CN1C2CC3CC1C(C2O)O3
InChI
InChI=1S/C8H13NO2/c1-9-5-2-4-3-6(9)8(11-4)7(5)10/h4-8,10H,2-3H2,1H3
InChI Key
MEGPURSNXMUDAE-UHFFFAOYSA-N
Boiling Point
248° C at 760 mmHg (Predicted)
Melting Point
107-109 °C
Flash Point
111.6ºC
Purity
95%+
Density
1.284 g/cm³
Storage
room temperature
Complexity
197
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
EC Number
207-655-3
Exact Mass
155.094628657
Heavy Atom Count
11
Monoisotopic Mass
155.094628657
Physical State
Powder
Rotatable Bond Count
0
Topological Polar Surface Area
32.7 Ų
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