1-{[(tert-butoxycarbonyl)amino]methyl}cyclopentane-1-carboxylic acid

1-{[(tert-butoxycarbonyl)amino]methyl}cyclopentane-1-carboxylic acid

CAS: 204514-22-7

Formula: C12H21NO4

SMILES: CC(C)(C)OC(=O)NCC1(CCCC1)C(O)=O

IUPAC: 1-({[(tert-butoxy)carbonyl]amino}methyl)cyclopentane-1-carboxylic acid

InChI: InChI=1S/C12H21NO4/c1-11(2,3)17-10(16)13-8-12(9(14)15)6-4-5-7-12/h4-8H2,1-3H3,(H,13,16)(H,14,15)

Composition: C (59.24%), H (8.70%), N (5.76%), O (26.30%)

Molar Mass: 243.303

Atom Count: 38

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	243.14705816
Formal Charge	0
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	SZCQGYCDQVOYDH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.05
Topological Polar Surface Area	75.63
Polarizability	24.58
Ring Count	1
Rotatable Bond Count	5

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