tert-butyl 4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate hydrochloride

tert-butyl 4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate hydrochloride

CAS: 1217803-39-8

Formula: C10H21ClN2O3

SMILES: Cl.CC(C)(C)OC(=O)N1CC(N)CC1CO

IUPAC: tert-butyl 4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylate hydrochloride

InChI: InChI=1/C10H20N2O3.ClH/c1-10(2,3)15-9(14)12-5-7(11)4-8(12)6-13;/h7-8,13H,4-6,11H2,1-3H3;1H

Composition: C (47.52%), H (8.38%), Cl (14.03%), N (11.08%), O (18.99%)

Molar Mass: 252.74

Atom Count: 37

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	252.1240702
Formal Charge	0
FSP3	0.9
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	CBLODQXSQDSMHU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	56.17
Topological Polar Surface Area	75.79
Polarizability	22.5
Ring Count	1
Rotatable Bond Count	3

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