 Home > Encyclopedia > 2,9-dithia-5,6,12,13-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),6,13-tetraene-4,11-dione

2,9-dithia-5,6,12,13-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),6,13-tetraene-4,11-dione

2,9-dithia-5,6,12,13-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),6,13-tetraene-4,11-dione structure

CAS No:
13617-04-4
Formula:
C8H4N4O2S2
Chemical Name:
2,9-dithia-5,6,12,13-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),6,13-tetraene-4,11-dione
Synonyms:
13617-04-4;NSC69004;UNII-P7JJ6VGU3C;P7JJ6VGU3C;9,10-Dithia-2,3,6,7-tetraaza-anthracene-1,5-diol;NSC 69004;NCIOpen2_003248;[?]-3,3-diol;CHEMBL4069907;DTXSID60159725;NSC-69004;ZINC17003013

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2,9-dithia-5,6,12,13-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),6,13-tetraene-4,11-dione Basic Attributes

Molecular Weight：

252.3 g/mol

Exact Mass：

251.97756773 g/mol

UNII：

P7JJ6VGU3C

NSC Number：

69004

DSSTox ID：

DTXSID60159725

Characteristics

PSA：

134 Å²

Computed Properties

Molecular Weight:252.3
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Exact Mass:251.97756773
Monoisotopic Mass:251.97756773
Topological Polar Surface Area:134
Heavy Atom Count:16
Complexity:484
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,9-dithia-5,6,12,13-tetrazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),6,13-tetraene-4,11-dione

Basic Attributes
Characteristics
Computed Properties

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