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9-imino-12-methyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

9-imino-12-methyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile structure

CAS No:
95059-21-5
Formula:
C14H14N4O2
Chemical Name:
9-imino-12-methyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile
Synonyms:
NSC681879;imino(methyl)[?]tricarbonitrile;CHEMBL1967997;HMS1620O06;STK761190;AKOS001727136;MCULE-1323199901;NSC-681879;NCI60_029315;SR-01000526306;SR-01000526306-1;2-imino-10-methyltetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile;7,7-dicyano-9-imino-12-methyl-10,11-dioxatricyclo[6.2.2.0~1,6~]dodec-8-yl cyanide;8a,3-(Epoxymethano)-8aH-1-benzopyran-3,4,4(2H,6H)-tricarbonitrile, tetrahydro-2-imino-10-methyl-;95059-21-5

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9-imino-12-methyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile Basic Attributes

Molecular Weight：

270.29 g/mol

Exact Mass：

270.11167570 g/mol

NSC Number：

681879

Characteristics

PSA：

114 Å²

XLogP3：

1.94234

Computed Properties

Molecular Weight:270.29
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Exact Mass:270.11167570
Monoisotopic Mass:270.11167570
Topological Polar Surface Area:114
Heavy Atom Count:20
Complexity:628
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-imino-12-methyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

Basic Attributes
Characteristics
Computed Properties

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