Text Search
Structure Search

ethyl 2-[(2E)-3-oxopiperazin-2-ylidene]acetate

ethyl 2-[(2E)-3-oxopiperazin-2-ylidene]acetate

CAS: 774-89-0

Formula: C8H12N2O3

SMILES: CCOC(=O)C=C1NCCNC1=O

IUPAC: ethyl 2-[(2E)-3-oxopiperazin-2-ylidene]acetate

InChI: InChI=1S/C8H12N2O3/c1-2-13-7(11)5-6-8(12)10-4-3-9-6/h5,9H,2-4H2,1H3,(H,10,12)/b6-5+

Composition: C (52.17%), H (6.57%), N (15.21%), O (26.06%)

Molar Mass: 184.195

Atom Count: 25

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 184.084792254
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey OMOSGPZSZJCWHI-AATRIKPKSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.27
Topological Polar Surface Area 67.43
Polarizability 17.69
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
MATRIX SCIENTIFIC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 774-89-0 $212.83-$327.27$212.83$327.27
Request Quote