2,5-bis(1,3-benzodioxol-5-ylmethylamino)-3,6-dimethoxycyclohexa-2,5-diene-1,4-dione
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2,5-bis(1,3-benzodioxol-5-ylmethylamino)-3,6-dimethoxycyclohexa-2,5-diene-1,4-dione
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CAS No:
27246-40-8
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Formula:
C24H22N2O8
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Chemical Name:
2,5-bis(1,3-benzodioxol-5-ylmethylamino)-3,6-dimethoxycyclohexa-2,5-diene-1,4-dione
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Synonyms:
MLS002706405;27246-40-8;NSC111331;CHEMBL1884033;DTXSID70296771;ZINC1703246;NSC-111331;2,5-Cyclohexadiene-1,4-dione,2,5-bis[(1,3-benzodioxol-5-ylmethyl)amino]-3,6-dimethoxy-;SMR001573813;DS-003674
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CAS No:
2,5-bis(1,3-benzodioxol-5-ylmethylamino)-3,6-dimethoxycyclohexa-2,5-diene-1,4-dione Basic Attributes
466.4 g/mol
466.13761566 g/mol
111331
DTXSID70296771
Computed Properties
Molecular Weight:466.4
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:466.13761566
Monoisotopic Mass:466.13761566
Topological Polar Surface Area:114
Heavy Atom Count:34
Complexity:801
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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