1,1-Diethoxy-2-propanamine - CAS 55064-41-0

Catalog:	BB067904
Product Name:	1,1-Diethoxy-2-propanamine
CAS:	55064-41-0
Synonyms:	2-Aminopropionaldehyde Diethyl Acetal; α-Aminopropionaldehyde Diethyl Acetal

Technical Data

IUPAC Name:	1,1-diethoxypropan-2-amine
Description:	1,1-Diethoxy-2-propanamine, can be used for the synthesis of N-protected α-amino aldehydes occur as C-terminal units of peptide aldehydes with enzyme inhibitor activity, such as Leupeptin. They can also be used for the preparation of amino sugars, and unusual amino acids.
Molecular Weight:	147.22
Molecular Formula:	C7H17NO2
Canonical SMILES:	CCOC(C(C)N)OCC
InChI:	InChI=1S/C7H17NO2/c1-4-9-7(6(3)8)10-5-2/h6-7H,4-5,8H2,1-3H3
InChI Key:	MLTOHCRTGWUMIR-UHFFFAOYSA-N
References:	Bringmann, G., et al. J. Synthesis, 608 (1989); Guillaumie, F., Tetrahedron Letters, 41, 6131 (200).

Complexity:	72
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.125928785
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	147.125928785
Rotatable Bond Count:	5
Topological Polar Surface Area:	44.5Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3