(2S)-2-{2-[(tert-butoxycarbonyl)amino]acetamido}-4-methylpentanoic acid

(2S)-2-{2-[(tert-butoxycarbonyl)amino]acetamido}-4-methylpentanoic acid

CAS: 51871-42-2

Formula: C13H24N2O5

SMILES: CC(C)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)C(O)=O

IUPAC: (2S)-2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)-4-methylpentanoic acid

InChI: InChI=1S/C13H24N2O5/c1-8(2)6-9(11(17)18)15-10(16)7-14-12(19)20-13(3,4)5/h8-9H,6-7H2,1-5H3,(H,14,19)(H,15,16)(H,17,18)/t9-/m0/s1

Composition: C (54.15%), H (8.39%), N (9.72%), O (27.74%)

Molar Mass: 288.344

Atom Count: 44

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	288.168521881
Formal Charge	0
FSP3	0.77
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	RGNNFKYULPHSJI-VIFPVBQESA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.85
Topological Polar Surface Area	104.73
Polarizability	28.41
Ring Count	0
Rotatable Bond Count	8

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	51871-42-2		$22.70$22.70