AG00C1ON

214629-97-7 | Boc-Orn-OtBu HCl

AG00C1ON

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CAS Number	214629-97-7
Catalog Number	AG00C1ON(AGN-PC-0QY0BS)
Chemical Name	Boc-Orn-OtBu HCl
IUPAC Name	tert-butyl (2S)-5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate;hydrochloride
InChI	InChI=1S/C14H28N2O4.ClH/c1-13(2,3)19-11(17)10(8-7-9-15)16-12(18)20-14(4,5)6;/h10H,7-9,15H2,1-6H3,(H,16,18);1H/t10-;/m0./s1
InChI Key	QAOZFDDKCLTTAV-PPHPATTJSA-N
MDL Number	MFCD01318721
Molecular Formula	C14H29ClN2O4
Molecular Weight	324.8441
SMILES	NCCC[C@@H](C(OC(C)(C)C)=O)NC(OC(C)(C)C)=O.[H]Cl
Synonyms	Boc-Orn-OtBu HCl, 214629-97-7, (S)-tert-Butyl 5-amino-2-((tert-butoxycarbonyl)amino)pentanoate hydrochloride, N-[(1,1-Dimethylethoxy)carbonyl]-L-ornithine tert-butyl ester hydrochloride, Boc-orn-OtBu hydrochloride, C14H28N2O4.HCl, SCHEMBL6809172, DTXSID80718494, MFCD01318721, SC-20647, AX8212744, V4354, B-7879, Nalpha-Boc-L-ornithine tert-Butyl Ester Hydrochloride, tert-Butyl N~2~-(tert-butoxycarbonyl)-L-ornithinate--hydrogen chloride (1/1), BOC-ORN-OTBUHCL, Boc-Orn-OtBu . HCl,

Complexity	329
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	324.182g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	324.846g/mol
Monoisotopic Mass	324.182g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	90.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number