Name: Name:1-Benzyl-1,7-diaza-spiro[4.4]nonane-7-carboxylic acid tert-butyl ester
Brand: Angene
SKU: AG00ELSE
Rating: 90 (10 reviews)

1-Benzyl-1,7-diaza-spiro[4.4]nonane-7-carboxylic acid tert-butyl ester

CAS No.:

646055-62-1

Catalog Number:

AG00ELSE

Molecular Formula:

C19H28N2O2

Molecular Weight:

316.4378

Catalog Number:

AG00ELSE

Chemical Name:

1-Benzyl-1,7-diaza-spiro[4.4]nonane-7-carboxylic acid tert-butyl ester

CAS Number:

646055-62-1

Molecular Formula:

C19H28N2O2

Molecular Weight:

316.4378

MDL Number:

MFCD13184530

IUPAC Name:

tert-butyl 1-benzyl-1,7-diazaspiro[4.4]nonane-7-carboxylate

InChI:

InChI=1S/C19H28N2O2/c1-18(2,3)23-17(22)20-13-11-19(15-20)10-7-12-21(19)14-16-8-5-4-6-9-16/h4-6,8-9H,7,10-15H2,1-3H3

InChI Key:

LECMSITUHGZUDO-UHFFFAOYSA-N

SMILES:

O=C(N1CCC2(C1)CCCN2Cc1ccccc1)OC(C)(C)C

Complexity:

426

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

316.215g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

316.445g/mol

Monoisotopic Mass:

316.215g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1