(2R)-6-amino-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hexanoic acid hydrochloride

(2R)-6-amino-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hexanoic acid hydrochloride

CAS: 201002-47-3

Formula: C21H25ClN2O4

SMILES: Cl.NCCCC[C@@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(O)=O

IUPAC: (2R)-6-amino-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanoic acid hydrochloride

InChI: InChI=1S/C21H24N2O4.ClH/c22-12-6-5-11-19(20(24)25)23-21(26)27-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18;/h1-4,7-10,18-19H,5-6,11-13,22H2,(H,23,26)(H,24,25);1H/t19-;/m1./s1

Composition: C (62.30%), H (6.22%), Cl (8.76%), N (6.92%), O (15.81%)

Molar Mass: 404.89

Atom Count: 53

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	404.150285
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	MVMZFAIUUXYFGY-FSRHSHDFSA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.89
Topological Polar Surface Area	101.65
Polarizability	41.05
Ring Count	3
Rotatable Bond Count	9

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