N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-3-methylbutan-1-amine
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N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-3-methylbutan-1-amine
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CAS No:
510759-00-9
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Formula:
C15H23NO2
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Chemical Name:
N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-3-methylbutan-1-amine
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Synonyms:
(5,9-Dihydro-6,8-dioxa-benzocyclohepten-7-ylmethyl)-(3-methyl-butyl)-amine;510759-00-9;TimTec1_007282;CHEMBL1617168;HMS1554K22;ZINC2362643;CCG-22445;N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-3-methylbutan-1-amine;STK546794;AKOS000301064;MCULE-6439839401;ST50020676;(1H,3H,5H-benzo[e]1,3-dioxepin-3-ylmethyl)(3-methylbutyl)amine;N-((1,5-Dihydrobenzo[e][1,3]dioxepin-3-yl)methyl)-3-methylbutan-1-amine
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CAS No:
N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-3-methylbutan-1-amine Basic Attributes
249.35 g/mol
249.172878976 g/mol
Computed Properties
Molecular Weight:249.35
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:249.172878976
Monoisotopic Mass:249.172878976
Topological Polar Surface Area:30.5
Heavy Atom Count:18
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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