Name: Name:Methyl 1-cyanocyclobutanecarboxylate
Brand: AABLOCKS
SKU: AA00ED3W
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00ED3W

Chemical Name: Methyl 1-cyanocyclobutanecarboxylate

CAS Number: 58920-79-9

Molecular Formula: C7H9NO2

Molecular Weight: 139.1519

MDL Number: MFCD10758063

SMILES: COC(=O)C1(CCC1)C#N

Properties

Storage: Keep in dry area;2-8℃;

Complexity: 197

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 10

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 0.9

Downstream Synthesis Route

109-64-8

105-34-0

58920-79-9

[1]CurrentPatentAssignee:KAOHSIUNGMEDICALUNIVERSITY-US2007/207087,2007,A1Locationinpatent:Page/Pagecolumn4;7;sheet1

[2]CurrentPatentAssignee:NATIONALYANGMINGCHIAOTUNGUNIVERSITY-US2011/65905,2011,A1Locationinpatent:Page/Pagecolumn7-8

[3]Oediger,H.;Moeller,F.[JustusLiebigsAnnalenderChemie,1976,p.348-351]

[4]Locationinpatent:experimentalpartChang,Ya-Hui;Chen,Chiao-Yun;Singh,Gyan;Chen,Hsing-Yin;Liu,Gin-Chung;Goan,Yih-Gang;Aime,Silvio;Wang,Yun-Ming[InorganicChemistry,2011,vol.50,#4,p.1275-1287]

58920-79-9

1027337-70-7

[1]Seebach,Dieter;Abele,Stefan;Sifferlen,Thierry;Haenggi,Martin;Gruner,Sibylle;Seiler,Paul[HelveticaChimicaActa,1998,vol.81,#12,p.2218-2243]

58920-79-9

205173-66-6

[1]Seebach,Dieter;Abele,Stefan;Sifferlen,Thierry;Haenggi,Martin;Gruner,Sibylle;Seiler,Paul[HelveticaChimicaActa,1998,vol.81,#12,p.2218-2243]

58920-79-9

1-(<<(ter-butoxy)carbonyl>amino>methyl)cyclobutane-1-carboxylicacid

[1]Seebach,Dieter;Abele,Stefan;Sifferlen,Thierry;Haenggi,Martin;Gruner,Sibylle;Seiler,Paul[HelveticaChimicaActa,1998,vol.81,#12,p.2218-2243]

58920-79-9

methyl1-(<<(tert-butoxy)carbonyl>amino>methyl)cyclobutane-1-carboxylate

[1]Seebach,Dieter;Abele,Stefan;Sifferlen,Thierry;Haenggi,Martin;Gruner,Sibylle;Seiler,Paul[HelveticaChimicaActa,1998,vol.81,#12,p.2218-2243]

58920-79-9 | Methyl 1-cyanocyclobutanecarboxylate