2-[(tert-butoxycarbonyl)amino]-3-cyclohexylpropanoic acid

2-[(tert-butoxycarbonyl)amino]-3-cyclohexylpropanoic acid

CAS: 144186-13-0

Formula: C14H25NO4

SMILES: CC(C)(C)OC(=O)NC(CC1CCCCC1)C(O)=O

IUPAC: 2-{[(tert-butoxy)carbonyl]amino}-3-cyclohexylpropanoic acid

InChI: InChI=1/C14H25NO4/c1-14(2,3)19-13(18)15-11(12(16)17)9-10-7-5-4-6-8-10/h10-11H,4-9H2,1-3H3,(H,15,18)(H,16,17)

Composition: C (61.97%), H (9.29%), N (5.16%), O (23.58%)

Molar Mass: 271.357

Atom Count: 44

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	271.178358289
Formal Charge	0
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	MSZQAQJBXGTSHP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.04
Topological Polar Surface Area	75.63
Polarizability	28.24
Ring Count	1
Rotatable Bond Count	6

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