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2-(tert-butoxycarbonyl)-5-oxa-2-azaspiro[3.4]octane-6-carboxylic acid

2-(tert-butoxycarbonyl)-5-oxa-2-azaspiro[3.4]octane-6-carboxylic acid

CAS: 1251006-00-4

Formula: C12H19NO5

SMILES: CC(C)(C)OC(=O)N1CC2(C1)CCC(O2)C(O)=O

IUPAC: 2-[(tert-butoxy)carbonyl]-5-oxa-2-azaspiro[3.4]octane-6-carboxylic acid

InChI: InChI=1/C12H19NO5/c1-11(2,3)18-10(16)13-6-12(7-13)5-4-8(17-12)9(14)15/h8H,4-7H2,1-3H3,(H,14,15)

Composition: C (56.02%), H (7.44%), N (5.44%), O (31.09%)

Molar Mass: 257.286

Atom Count: 37

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 257.126322716
Formal Charge 0
FSP3 0.83
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey ZNSDOJYTRJPKOY-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.69
Topological Polar Surface Area 76.07
Polarizability 24.62
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 1251006-00-4 $353.81-$3,538.08$353.81$589.68$1,179.36$3,538.08
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