tert-butyl 4-(3-iodopropyl)piperidine-1-carboxylate

tert-butyl 4-(3-iodopropyl)piperidine-1-carboxylate

CAS: 142374-14-9

Formula: C13H24INO2

SMILES: CC(C)(C)OC(=O)N1CCC(CCCI)CC1

IUPAC: tert-butyl 4-(3-iodopropyl)piperidine-1-carboxylate

InChI: InChI=1S/C13H24INO2/c1-13(2,3)17-12(16)15-9-6-11(7-10-15)5-4-8-14/h11H,4-10H2,1-3H3

Composition: C (44.20%), H (6.85%), I (35.93%), N (3.97%), O (9.06%)

Molar Mass: 353.244

Atom Count: 41

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	353.08517
Formal Charge	0
FSP3	0.92
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	NLHWDDDFOOUXKD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.79
Topological Polar Surface Area	29.54
Polarizability	30.83
Ring Count	1
Rotatable Bond Count	5

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