(4R)-4-[(tert-butoxycarbonyl)amino]-6-methylheptanoic acid

(4R)-4-[(tert-butoxycarbonyl)amino]-6-methylheptanoic acid

CAS: 146453-32-9

Formula: C13H25NO4

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

IUPAC: (4R)-4-{[(tert-butoxy)carbonyl]amino}-6-methylheptanoic acid

InChI: InChI=1S/C13H25NO4/c1-9(2)8-10(6-7-11(15)16)14-12(17)18-13(3,4)5/h9-10H,6-8H2,1-5H3,(H,14,17)(H,15,16)/t10-/m1/s1

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	1
Exact Mass	259.178358289
Formal Charge	0
FSP3	0.85
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ILHMTULQPDRVLS-SNVBAGLBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.42
Topological Polar Surface Area	75.63
Polarizability	27.13
Ring Count	0
Rotatable Bond Count	8

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