2-(tert-butoxycarbonyl)-5-oxa-2,6-diazaspiro[3.4]oct-6-ene-7-carboxylic acid

2-(tert-butoxycarbonyl)-5-oxa-2,6-diazaspiro[3.4]oct-6-ene-7-carboxylic acid

CAS: 1273576-64-9

Formula: C11H16N2O5

SMILES: CC(C)(C)OC(=O)N1CC2(C1)CC(=NO2)C(O)=O

IUPAC: 2-[(tert-butoxy)carbonyl]-5-oxa-2,6-diazaspiro[3.4]oct-6-ene-7-carboxylic acid

InChI: InChI=1S/C11H16N2O5/c1-10(2,3)17-9(16)13-5-11(6-13)4-7(8(14)15)12-18-11/h4-6H2,1-3H3,(H,14,15)

Composition: C (51.56%), H (6.29%), N (10.93%), O (31.22%)

Molar Mass: 256.258

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	256.105921623
Formal Charge	0
FSP3	0.73
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	HSBSFXGYYQDTBF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.74
Topological Polar Surface Area	88.43
Polarizability	23.56
Ring Count	2
Rotatable Bond Count	3

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