Name: Name:1-Piperidinecarboxylic acid, 4-(2-cyano-2-hydroxyethyl)-, 1,1-diMethylethyl ester
Brand: Angene
SKU: AG00GTYP
Rating: 90 (10 reviews)

1-Piperidinecarboxylic acid, 4-(2-cyano-2-hydroxyethyl)-, 1,1-diMethylethyl ester

CAS No.:

885516-98-3

Catalog Number:

AG00GTYP

Molecular Formula:

C13H22N2O3

Molecular Weight:

254.3254

Catalog Number:

AG00GTYP

Chemical Name:

1-Piperidinecarboxylic acid, 4-(2-cyano-2-hydroxyethyl)-, 1,1-diMethylethyl ester

CAS Number:

885516-98-3

Molecular Formula:

C13H22N2O3

Molecular Weight:

254.3254

MDL Number:

MFCD22571234

IUPAC Name:

tert-butyl 4-(2-cyano-2-hydroxyethyl)piperidine-1-carboxylate

InChI:

InChI=1S/C13H22N2O3/c1-13(2,3)18-12(17)15-6-4-10(5-7-15)8-11(16)9-14/h10-11,16H,4-8H2,1-3H3

InChI Key:

FVBVBNNQZAWHNR-UHFFFAOYSA-N

SMILES:

N#CC(CC1CCN(CC1)C(=O)OC(C)(C)C)O

Complexity:

332

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.33g/mol

Monoisotopic Mass:

254.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4