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1331912-17-4

1331912-17-4 structural image
Product Name: N-4-(1-PYRENE)BUTYROYL-L-PHENYLALANINE, ETHYL ESTER
Formula: C31H29NO3
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COMPUTED DESCRIPTORS

Molecular Weight 463.6 g/mol
XLogP3 7.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 10
Exact Mass 463.21474379 g/mol
Monoisotopic Mass 463.21474379 g/mol
Topological Polar Surface Area 55.4 Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 716
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes