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5702-40-9

5702-40-9 structural image
Product Name: 2-NITRO-2-ETHYL-1,3-PROPANEDIOLBUTYRALDEHYDEACETAL
Formula: C9H17NO4
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COMPUTED DESCRIPTORS

Molecular Weight 203.24 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 203.11575802 g/mol
Monoisotopic Mass 203.11575802 g/mol
Topological Polar Surface Area 64.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 194
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