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338954-20-4

338954-20-4 structural image
Product Name: ETHYL 5-[(4-CHLORO-2-FORMYLPHENOXY)METHYL]-4,5-DIHYDRO-3-ISOXAZOLECARBOXYLATE
Formula: C14H14ClNO5
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COMPUTED DESCRIPTORS

Molecular Weight 311.72 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 311.0560502 g/mol
Monoisotopic Mass 311.0560502 g/mol
Topological Polar Surface Area 74.2 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 414
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