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456-12-2

456-12-2 structural image
Product Name: Aegelin
Formula: C18H19NO3
Synonyms: Aegeline;Egeline
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 176 °C

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 297.3 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 297.13649347 g/mol
Monoisotopic Mass 297.13649347 g/mol
Topological Polar Surface Area 58.6 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 355
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes