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methyl 4-[(2,4-dichlorophenyl)formohydrazido]-4-oxobutanoate

methyl 4-[(2,4-dichlorophenyl)formohydrazido]-4-oxobutanoate

Formula: C12H12Cl2N2O4

SMILES: COC(=O)CCC(=O)NNC(=O)C1=CC=C(Cl)C=C1Cl

IUPAC: methyl 4-[(2,4-dichlorophenyl)formohydrazido]-4-oxobutanoate

InChI: InChI=1S/C12H12Cl2N2O4/c1-20-11(18)5-4-10(17)15-16-12(19)8-3-2-7(13)6-9(8)14/h2-3,6H,4-5H2,1H3,(H,15,17)(H,16,19)

Composition: C (45.16%), H (3.79%), Cl (22.22%), N (8.78%), O (20.05%)

Molar Mass: 319.14

Atom Count: 32

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 318.0174123
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey IDJHBPDAVCMPJP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.27
Topological Polar Surface Area 84.5
Polarizability 28.34
Ring Count 1
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C12H12Cl2N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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