(2S)-5-(tert-butoxy)-2-acetamido-5-oxopentanoic acid

(2S)-5-(tert-butoxy)-2-acetamido-5-oxopentanoic acid

CAS: 84192-88-1

Formula: C11H19NO5

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

IUPAC: (2S)-5-(tert-butoxy)-2-acetamido-5-oxopentanoic acid

InChI: InChI=1S/C11H19NO5/c1-7(13)12-8(10(15)16)5-6-9(14)17-11(2,3)4/h8H,5-6H2,1-4H3,(H,12,13)(H,15,16)/t8-/m0/s1

Composition: C (53.87%), H (7.81%), N (5.71%), O (32.61%)

Molar Mass: 245.275

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	245.126322716
Formal Charge	0
FSP3	0.73
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	FALCCLKESWGSNI-QMMMGPOBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.31
Topological Polar Surface Area	92.7
Polarizability	23.61
Ring Count	0
Rotatable Bond Count	7

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