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3,6-bis(1,3-benzodioxol-5-yl)-1,4-dihydro-1,2,4,5-tetrazine

3,6-bis(1,3-benzodioxol-5-yl)-1,4-dihydro-1,2,4,5-tetrazine structure

CAS No:
81258-47-1
Formula:
C16H12N4O4
Chemical Name:
3,6-bis(1,3-benzodioxol-5-yl)-1,4-dihydro-1,2,4,5-tetrazine
Synonyms:
NSC171131;81258-47-1;DTXSID40305566;ZINC6513366;NSC-171131

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3,6-bis(1,3-benzodioxol-5-yl)-1,4-dihydro-1,2,4,5-tetrazine Basic Attributes

Molecular Weight：

324.29 g/mol

Exact Mass：

324.08585488 g/mol

NSC Number：

171131

DSSTox ID：

DTXSID40305566

Characteristics

PSA：

85.7 Å²

Computed Properties

Molecular Weight:324.29
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:324.08585488
Monoisotopic Mass:324.08585488
Topological Polar Surface Area:85.7
Heavy Atom Count:24
Complexity:506
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,6-bis(1,3-benzodioxol-5-yl)-1,4-dihydro-1,2,4,5-tetrazine

Basic Attributes
Characteristics
Computed Properties

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