Text Search
Structure Search

1,3-diethyl 2-{[(4-carbamoylphenyl)imino]methyl}propanedioate

1,3-diethyl 2-{[(4-carbamoylphenyl)imino]methyl}propanedioate

Formula: C15H18N2O5

SMILES: CCOC(=O)C(C=NC1=CC=C(C=C1)C(N)=O)C(=O)OCC

IUPAC: 1,3-diethyl 2-{[(4-carbamoylphenyl)imino]methyl}propanedioate

InChI: InChI=1S/C15H18N2O5/c1-3-21-14(19)12(15(20)22-4-2)9-17-11-7-5-10(6-8-11)13(16)18/h5-9,12H,3-4H2,1-2H3,(H2,16,18)

Composition: C (58.82%), H (5.92%), N (9.15%), O (26.12%)

Molar Mass: 306.318

Atom Count: 40

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 306.121571688
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey OJQZSZBUMXOJMX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.21
Topological Polar Surface Area 108.05
Polarizability 30.21
Ring Count 1
Rotatable Bond Count 9

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H18N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote