Name: Name:1-Azetidinecarboxylic acid, 3-amino-3-(aminocarbonyl)-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG000NNH
Rating: 90 (10 reviews)

1-Azetidinecarboxylic acid, 3-amino-3-(aminocarbonyl)-, 1,1-dimethylethyl ester

CAS No.:

1254120-14-3

Catalog Number:

AG000NNH

Molecular Formula:

C9H17N3O3

Molecular Weight:

215.2496

Catalog Number:

AG000NNH

Chemical Name:

1-Azetidinecarboxylic acid, 3-amino-3-(aminocarbonyl)-, 1,1-dimethylethyl ester

CAS Number:

1254120-14-3

Molecular Formula:

C9H17N3O3

Molecular Weight:

215.2496

MDL Number:

MFCD21842621

IUPAC Name:

tert-butyl 3-amino-3-carbamoylazetidine-1-carboxylate

InChI:

InChI=1S/C9H17N3O3/c1-8(2,3)15-7(14)12-4-9(11,5-12)6(10)13/h4-5,11H2,1-3H3,(H2,10,13)

InChI Key:

OAKMOLUZPTYUBR-UHFFFAOYSA-N

SMILES:

O=C(N1CC(C1)(N)C(=O)N)OC(C)(C)C

Complexity:

290

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

215.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

215.253g/mol

Monoisotopic Mass:

215.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

98.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.3