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9-(furan-2-yl)-12-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

9-(furan-2-yl)-12-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile structure

CAS No:
95059-25-9
Formula:
C17H14N4O3
Chemical Name:
9-(furan-2-yl)-12-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile
Synonyms:
NSC681881;Oprea1_038015;CHEMBL1993984;2-furyl(imino)[?]tricarbonitrile;STK529439;AKOS005462726;MCULE-2783706853;NSC-681881;NCI60_029317;2-(furan-2-yl)-10-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile;8a,3-(Epoxymethano)-8aH-1-benzopyran-3,4,4(2H,6H)-tricarbonitrile, 2-(2-furanyl)tetrahydro-10-imino-;95059-25-9

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9-(furan-2-yl)-12-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile Basic Attributes

Molecular Weight：

322.32 g/mol

Exact Mass：

322.10659032 g/mol

NSC Number：

681881

Characteristics

PSA：

127 Å²

XLogP3：

2.88814

Melting Point：

164 - 166 °C (ethyl acetate)

Computed Properties

Molecular Weight:322.32
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:322.10659032
Monoisotopic Mass:322.10659032
Topological Polar Surface Area:127
Heavy Atom Count:24
Complexity:736
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 2-bromo-2-methylbutane; acrolein; limestone formula; calcium carbonate formula; methyl alcohol chemical formula; dimethyl terephthalate

Guide of 9-(furan-2-yl)-12-imino-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

Basic Attributes
Characteristics
Computed Properties

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