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tert-butyl N-(3-methylazetidin-3-yl)carbamate hydrochloride

tert-butyl N-(3-methylazetidin-3-yl)carbamate hydrochloride

CAS: 1408076-37-8

Formula: C9H19ClN2O2

SMILES: Cl.CC(C)(C)OC(=O)NC1(C)CNC1

IUPAC: tert-butyl N-(3-methylazetidin-3-yl)carbamate hydrochloride

InChI: InChI=1S/C9H18N2O2.ClH/c1-8(2,3)13-7(12)11-9(4)5-10-6-9;/h10H,5-6H2,1-4H3,(H,11,12);1H

Composition: C (48.54%), H (8.60%), Cl (15.92%), N (12.58%), O (14.37%)

Molar Mass: 222.71

Atom Count: 33

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 222.1135056
Formal Charge 0
FSP3 0.89
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey STEWJDCKUINIMO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.86
Topological Polar Surface Area 50.36
Polarizability 20.02
Ring Count 1
Rotatable Bond Count 3

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