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80053-54-9

80053-54-9 structural image
Product Name: 2-ETHYLHEXAHYDRO-1H-AZEPINE
Formula: C8H17N
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COMPUTED DESCRIPTORS

Molecular Weight 127.23 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 127.136099547 g/mol
Monoisotopic Mass 127.136099547 g/mol
Topological Polar Surface Area 12 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 71
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