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ethyl 2-(3-oxopiperazin-2-yl)acetate

ethyl 2-(3-oxopiperazin-2-yl)acetate

CAS: 33422-35-4

Formula: C8H14N2O3

SMILES: CCOC(=O)CC1NCCNC1=O

IUPAC: ethyl 2-(3-oxopiperazin-2-yl)acetate

InChI: InChI=1/C8H14N2O3/c1-2-13-7(11)5-6-8(12)10-4-3-9-6/h6,9H,2-5H2,1H3,(H,10,12)

Composition: C (51.60%), H (7.58%), N (15.04%), O (25.78%)

Molar Mass: 186.211

Atom Count: 27

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 186.100442319
Formal Charge 0
FSP3 0.75
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey HNYRNJAZRKCHSC-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.57
Topological Polar Surface Area 67.43
Polarizability 18.31
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 33422-35-4 $76.67-$153.34$76.67$153.34
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OTAVA LTD.
Purity LeadTime CAS PacketSize UnitPrice
95% <10 Days 33422-35-4 $208.21-$733.13$208.21$304.00$494.62$733.13
MFCD00052897
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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 33422-35-4 $51.35-$1,632.20$51.35$63.37$86.31$272.03$544.07$1,632.20
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