Home> Encyclopedia > / Others

6-(4-(diethylamino)-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one structure

6-(4-(diethylamino)-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one structure

6-(4-(diethylamino)-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one

Iupac Name：sodium;5-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate

CAS No.: 85666-17-7

Molecular Weight：275.239

Modify Date.: 2022-05-08 22:02

Request For Quotation

1. Names and Identifiers

1.1 Name: 6-(4-(diethylamino)-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one
1.2 Synonyms: 3(2H)-Pyridazinone, 6-[4-(diethylamino)-3-nitrophenyl]-4,5-dihydro-5-methyl- 6-[4-(Diethylamino)-3-nitrophenyl]-5-methyl-4,5-dihydro-3(2H)-pyridazinone DNMDP compound MFCD01829240

1.3 CAS No.: 85666-17-7

1.4 CID: 23663954

1.5 Molecular Formula: C₂₄H₂₃FeP (isomer)

1.6 Inchi: InChI=1S/C15H11NO3.Na/c17-15(18)14-8-12-7-10(3-4-13(12)19-14)6-11-2-1-5-16-9-11;/h1-5,7-9H,6H2,(H,17,18);/q;+1/p-1

1.7 InChkey: XBTIPIZROJAKOJ-UHFFFAOYSA-M

1.8 Canonical Smiles: C1=CC(=CN=C1)CC2=CC3=C(C=C2)OC(=C3)C(=O)[O-].[Na+]

1.9 Isomers Smiles: C1=CC(=CN=C1)CC2=CC3=C(C=C2)OC(=C3)C(=O)[O-].[Na+]

2. Properties

3.1 Precise Quality: 275.05600

3.1 PSA: 66.16000

3.1 logP: 1.78210

3. Computational chemical data

Molecular Weight: 275.239g/mol
Molecular Formula: C_₂₄H_₂₃FeP
Compound Is Canonicalized: True
XLogP3-AA:
Exact Mass: 275.05583746
Monoisotopic Mass: 275.05583746
Complexity: 339
Rotatable Bond Count: 3
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 4
Topological Polar Surface Area: 66.2
Heavy Atom Count: 20
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 2

4. Recommended Suppliers

Global3SuppliersView all >>

Alexis Corporation Manufacturer

Manufacturer

Tel:+41 61 926 8989

U-63557A

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2019/11/25

Inquire

BIOMOL INTERNATIONAL, LP Manufacturer

Manufacturer

Tel:(800) 942-0430

U-63557A

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2019/11/25

Inquire

Cayman Chemical Company

Tel:+1-(734)-975-3939

Furegrelate (sodium salt)

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2019/11/25

Inquire

Directory

1. Names and Identifiers

1.5 Molecular Formula

1.8 Canonical Smiles

1.9 Isomers Smiles

2. Properties

3.1 Precise Quality

3.Computational chemical data

4.Recommended Suppliers