2-aminoadamantane-2-carboxylic acid hydrochloride

2-aminoadamantane-2-carboxylic acid hydrochloride

CAS: 50294-51-4

Formula: C11H18ClNO2

SMILES: Cl.NC1(C2CC3CC(C2)CC1C3)C(O)=O

IUPAC: 2-aminoadamantane-2-carboxylic acid hydrochloride

InChI: InChI=1S/C11H17NO2.ClH/c12-11(10(13)14)8-2-6-1-7(4-8)5-9(11)3-6;/h6-9H,1-5,12H2,(H,13,14);1H

Composition: C (57.02%), H (7.83%), Cl (15.30%), N (6.04%), O (13.81%)

Molar Mass: 231.72

Atom Count: 33

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	231.1026065
Formal Charge	0
FSP3	0.91
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	YANCSAPAJAELIU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.49
Topological Polar Surface Area	63.32
Polarizability	20.85
Ring Count	3
Rotatable Bond Count	1

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