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9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile structure

CAS No:
95059-20-4
Formula:
C13H12N4O2
Chemical Name:
9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile
Synonyms:
NSC681878;MLS001049393;SMR000426795;imino[?]tricarbonitrile;CHEMBL1366286;HMS2798C18;STK535329;AKOS005466977;MCULE-4855736187;NSC-681878;NCI60_029314;SR-01000772219;SR-01000772219-2;2-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile;8a,3-(Epoxymethano)-8aH-1-benzopyran-3,4,4(2H,6H)-tricarbonitrile, tetrahydro-2-imino-;9-Imino-10,11-dioxa-tricyclo[6.2.2.0*1,6*]dodecane-7,7,8-tricarbonitrile;95059-20-4

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9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile Basic Attributes

Molecular Weight：

256.26 g/mol

Exact Mass：

256.09602564 g/mol

NSC Number：

681878

Characteristics

PSA：

114 Å²

XLogP3：

1.55384

Melting Point：

127 - 129 °C (hexane)

Computed Properties

Molecular Weight:256.26
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Exact Mass:256.09602564
Monoisotopic Mass:256.09602564
Topological Polar Surface Area:114
Heavy Atom Count:19
Complexity:598
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: subperiosteal abscess; red88.ag; ankle dislocation; combi blocks; carbonyl sulfide; mno2

Guide of 9-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

Basic Attributes
Characteristics
Computed Properties

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