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404586-94-3

404586-94-3 structural image
Product Name: BOC-1-TERT-BUTOXY-1,2-DIHYDROISOQUINOLIN
Formula: C18H25NO3
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral

COMPUTED DESCRIPTORS

Molecular Weight 303.4 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 303.18344366 g/mol
Monoisotopic Mass 303.18344366 g/mol
Topological Polar Surface Area 38.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 431
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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