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tert-butyl (1r,4r)-4-aminocyclohexane-1-carboxylate

tert-butyl (1r,4r)-4-aminocyclohexane-1-carboxylate

CAS: 1022159-15-4

Formula: C11H21NO2

SMILES: CC(C)(C)OC(=O)[C@H]1CC[C@H](N)CC1

IUPAC: tert-butyl (1r,4r)-4-aminocyclohexane-1-carboxylate

InChI: InChI=1/C11H21NO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h8-9H,4-7,12H2,1-3H3/t8-,9-

Composition: C (66.29%), H (10.62%), N (7.03%), O (16.06%)

Molar Mass: 199.294

Atom Count: 35

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 199.15722892
Formal Charge 0
FSP3 0.91
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XDTZRQLZSNTGSM-KYZUINATNA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.75
Topological Polar Surface Area 52.32
Polarizability 22.55
Ring Count 1
Rotatable Bond Count 3

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