Name: Name:Trans-4-n-boc-aminomethyl-1-cyclohexane acetonitrile
Brand: Angene
SKU: AG0021NY
Rating: 90 (10 reviews)

Trans-4-n-boc-aminomethyl-1-cyclohexane acetonitrile

CAS No.:

180046-56-4

Catalog Number:

AG0021NY

Molecular Formula:

C14H24N2O2

Molecular Weight:

252.3526

Catalog Number:

AG0021NY

Chemical Name:

Trans-4-n-boc-aminomethyl-1-cyclohexane acetonitrile

CAS Number:

180046-56-4

Molecular Formula:

C14H24N2O2

Molecular Weight:

252.3526

MDL Number:

MFCD08062252

IUPAC Name:

tert-butyl N-[[4-(cyanomethyl)cyclohexyl]methyl]carbamate

InChI:

InChI=1S/C14H24N2O2/c1-14(2,3)18-13(17)16-10-12-6-4-11(5-7-12)8-9-15/h11-12H,4-8,10H2,1-3H3,(H,16,17)

InChI Key:

DSHSAPVSNPCWLW-UHFFFAOYSA-N

SMILES:

N#CC[C@@H]1CC[C@H](CC1)CNC(=O)OC(C)(C)C

Complexity:

316

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

252.184g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

252.358g/mol

Monoisotopic Mass:

252.184g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7