N-Boc-Lys-OtBu Hydrochloride - CAS 7750-45-0

Catalog:	BB072434
Product Name:	N-Boc-Lys-OtBu Hydrochloride
CAS:	7750-45-0
Synonyms:	N2-[(1,1-Dimethylethoxy)carbonyl]-L-lysine 1,1-Dimethylethyl Ester Hydrochloride; N-Boc-lysine t-Butyl Ester Hydrochloride; Nα-(t-Butoxycarbonyl)lysine t-Butyl Ester Hydrochloride

Technical Data

IUPAC Name:	tert-butyl (2S)-6-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoatehydrochloride
Description:	N-Boc-Lys(Z)-OtBu Hydrochloride is an intermediate used in the synthesis of Isodesmosine Chloride Hydrate (Synthetic) (I815051), which is a component of elastin and also it is extremely hygroscopic and must be stored over a desiccant such as silica gel.
Molecular Weight:	302.41 +(36.46)
Molecular Formula:	C15H30N2O4·HCl
Canonical SMILES:	CC(C)(C)OC(=O)C(CCCCN)NC(=O)OC(C)(C)C.Cl
InChI:	InChI=1S/C15H30N2O4.ClH/c1-14(2,3)20-12(18)11(9-7-8-10-16)17-13(19)21-15(4,5)6/h11H,7-10,16H2,1-6H3,(H,17,19)1H/t11-/m0./s1
InChI Key:	DZPNNJVSGWQNCP-MERQFXBCSA-N
Solubility:	DMSO (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly), Water (Slightly)
Appearance:	Off-White to Pale Yellow Sticky Solid
Storage:	-20°C, Hygroscopic
References:	Partridge, S., et al. Nature, 209, 399 (1966).

Complexity:	343
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	338.1972352
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	338.1972352
Rotatable Bond Count:	10
Topological Polar Surface Area:	90.6Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0