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(2S,5R)-5-[(tert-butoxycarbonyl)amino]oxane-2-carboxylic acid

(2S,5R)-5-[(tert-butoxycarbonyl)amino]oxane-2-carboxylic acid

CAS: 603130-13-8

Formula: C11H19NO5

SMILES: CC(C)(C)OC(=O)N[C@@H]1CC[C@H](OC1)C(O)=O

IUPAC: (2S,5R)-5-{[(tert-butoxy)carbonyl]amino}oxane-2-carboxylic acid

InChI: InChI=1S/C11H19NO5/c1-11(2,3)17-10(15)12-7-4-5-8(9(13)14)16-6-7/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8+/m1/s1

Composition: C (53.87%), H (7.81%), N (5.71%), O (32.61%)

Molar Mass: 245.275

Atom Count: 36

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 245.126322716
Formal Charge 0
FSP3 0.82
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey NROSRTMHTJHLLE-SFYZADRCSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.88
Topological Polar Surface Area 84.86
Polarizability 23.5
Ring Count 1
Rotatable Bond Count 4

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Key Organics Ltd
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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 603130-13-8 $639.11-$1,211.58$639.11$639.11$1,211.58$1,211.58
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95% <5 Days 603130-13-8 $81.97-$5,528.22$81.97$136.19$229.50$345.51$1,066.81$1,778.01$3,553.50$5,528.22
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J&W PHARMLAB LLC
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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 603130-13-8 $457.70-$1,828.50$457.70$1,828.50
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