Name: Name:1-Piperazinecarboxylic acid, 4-[2-(aminomethyl)phenyl]-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG002004
Rating: 90 (10 reviews)

1-Piperazinecarboxylic acid, 4-[2-(aminomethyl)phenyl]-, 1,1-dimethylethyl ester

CAS No.:

174855-53-9

Catalog Number:

AG002004

Molecular Formula:

C16H25N3O2

Molecular Weight:

291.3886

Catalog Number:

AG002004

Chemical Name:

1-Piperazinecarboxylic acid, 4-[2-(aminomethyl)phenyl]-, 1,1-dimethylethyl ester

CAS Number:

174855-53-9

Molecular Formula:

C16H25N3O2

Molecular Weight:

291.3886

MDL Number:

MFCD04115066

IUPAC Name:

tert-butyl 4-[2-(aminomethyl)phenyl]piperazine-1-carboxylate

InChI:

InChI=1S/C16H25N3O2/c1-16(2,3)21-15(20)19-10-8-18(9-11-19)14-7-5-4-6-13(14)12-17/h4-7H,8-12,17H2,1-3H3

InChI Key:

UINNZXQKTNAOBL-UHFFFAOYSA-N

SMILES:

NCc1ccccc1N1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

346

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.195g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.395g/mol

Monoisotopic Mass:

291.195g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6