Name: Name:1,3-diethyl 2-(but-2-yn-1-yl)-2-acetamidopropanedioate
Brand: Angene
SKU: AG01ABOG
Rating: 90 (10 reviews)

1,3-diethyl 2-(but-2-yn-1-yl)-2-acetamidopropanedioate

CAS No.:

19013-58-2

Catalog Number:

AG01ABOG

Molecular Formula:

C13H19NO5

Molecular Weight:

269.2937

Catalog Number:

AG01ABOG

Chemical Name:

1,3-diethyl 2-(but-2-yn-1-yl)-2-acetamidopropanedioate

CAS Number:

19013-58-2

Molecular Formula:

C13H19NO5

Molecular Weight:

269.2937

MDL Number:

MFCD26407662

IUPAC Name:

diethyl 2-acetamido-2-but-2-ynylpropanedioate

InChI:

InChI=1S/C13H19NO5/c1-5-8-9-13(14-10(4)15,11(16)18-6-2)12(17)19-7-3/h6-7,9H2,1-4H3,(H,14,15)

InChI Key:

ARYOHSPMMPIENV-UHFFFAOYSA-N

SMILES:

CCOC(=O)C(C(=O)OCC)(NC(=O)C)CC#CC

Complexity:

397

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.297g/mol

Monoisotopic Mass:

269.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2