2-amino-3-(tert-butoxycarbonyl)-4-ethylhexanoic acid

2-amino-3-(tert-butoxycarbonyl)-4-ethylhexanoic acid

CAS: 776330-51-9

Formula: C13H25NO4

SMILES: CCC(CC)C(C(N)C(O)=O)C(=O)OC(C)(C)C

IUPAC: 2-amino-3-[(tert-butoxy)carbonyl]-4-ethylhexanoic acid

InChI: InChI=1/C13H25NO4/c1-6-8(7-2)9(10(14)11(15)16)12(17)18-13(3,4)5/h8-10H,6-7,14H2,1-5H3,(H,15,16)

Composition: C (60.21%), H (9.72%), N (5.40%), O (24.68%)

Molar Mass: 259.346

Atom Count: 43

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	259.178358289
Formal Charge	0
FSP3	0.85
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	BPSMRXSHZMZFOS-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.03
Topological Polar Surface Area	89.62
Polarizability	27.5
Ring Count	0
Rotatable Bond Count	8

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	776330-51-9		$122.13-$1,565.96$122.13$217.35$399.51$867.33$1,565.96