Name: Name:4-(Methoxymethyl)benzonitrile
Brand: AABLOCKS
SKU: AA001NAR
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA001NAR

Chemical Name: 4-(Methoxymethyl)benzonitrile

CAS Number: 1515-85-1

Molecular Formula: C9H9NO

Molecular Weight: 147.1739

MDL Number: MFCD09937189

SMILES: COCc1ccc(cc1)C#N

Properties

Complexity: 150

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 11

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.3

Downstream Synthesis Route

1515-88-4

1515-85-1

[1]Marvel;Overberger[JournaloftheAmericanChemicalSociety,1944,vol.66,p.475]

874-89-5

74-88-4

1515-85-1

[1]JournalofMedicinalChemistry,2010,vol.53,p.1288-1305

[2]Patent:WO2009/145816,2009,A2.Locationinpatent:Page/Pagecolumn59

[3]Patent:WO2011/95625,2011,A1.Locationinpatent:Page/Pagecolumn94-95

[4]OrganicMassSpectrometry,1990,vol.25,p.649-654

[5]Patent:WO2018/132372,2018,A1.Locationinpatent:Paragraph00480

[6]Patent:US2009/239876,2009,A1.Locationinpatent:Page/Pagecolumn51

201230-82-2

1515-88-4

33513-42-7

1515-85-1

4-methoxymethyl-benzamide

C10H11NO3

N-1-Dimethylamino-meth-(E)-ylidene-4-methoxymethyl-benzamide

[1]Ueda;Sato;Mori[JournaloftheAmericanChemicalSociety,2000,vol.122,#43,p.10722-10723]

201230-82-2

1515-88-4

107-12-0

1515-85-1

4-methoxymethyl-benzamide

4-methoxymethyl-<i>N</i>-(4-methoxymethyl-benzoyl)-benzamide

[1]Ueda;Sato;Mori[JournaloftheAmericanChemicalSociety,2000,vol.122,#43,p.10722-10723]

623-03-0

910251-11-5

1515-85-1

[1]OrganicLetters,2008,vol.10,p.2135-2138

1515-85-1 | 4-(Methoxymethyl)benzonitrile