Text Search
Structure Search

2-{[1-(tert-butoxycarbonyl)piperidin-4-yl]oxy}propanoic acid

2-{[1-(tert-butoxycarbonyl)piperidin-4-yl]oxy}propanoic acid

CAS: 952486-65-6

Formula: C13H23NO5

SMILES: CC(OC1CCN(CC1)C(=O)OC(C)(C)C)C(O)=O

IUPAC: 2-({1-[(tert-butoxy)carbonyl]piperidin-4-yl}oxy)propanoic acid

InChI: InChI=1/C13H23NO5/c1-9(11(15)16)18-10-5-7-14(8-6-10)12(17)19-13(2,3)4/h9-10H,5-8H2,1-4H3,(H,15,16)

Composition: C (57.13%), H (8.48%), N (5.12%), O (29.27%)

Molar Mass: 273.329

Atom Count: 42

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 273.157622845
Formal Charge 0
FSP3 0.85
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey YHKRUDZVAIDLNI-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.74
Topological Polar Surface Area 76.07
Polarizability 27.15
Ring Count 1
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 952486-65-6 $51.35-$292.79$51.35$63.37$86.31$292.79
Request Quote
Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 952486-65-6 $51.35-$225.06$51.35$63.37$86.31$225.06
Request Quote