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331768-69-5

331768-69-5 structural image
Product Name: Dibenzo[b,d][1,6]dioxacyclotetradecin, 1,18-bis(diphenylphosphino)-6,7,8,9,10,11,12,13-octahydro-, (18aR)- (9CI)
Formula: C44H42O2P2
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COMPUTED DESCRIPTORS

Molecular Weight 664.7 g/mol
XLogP3 11.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 664.26600457 g/mol
Monoisotopic Mass 664.26600457 g/mol
Topological Polar Surface Area 18.5 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 780
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes