N-(2,4-Dinitrophenyl)-6-aminohexanoic acid supplier

Name
N-(2,4-DINITROPHENYL)-6-AMINOHEXANOIC ACID
EINECS
CAS No. 10466-72-5
Article Data6
CAS DataBase
Density 1.417±0.06 g/cm3(Predicted)
Solubility
Melting Point 133 °C
Formula C₁₂H₁₅N₃O₆
Boiling Point 532.5±50.0 °C(Predicted)
Molecular Weight 297.268
Flash Point
Transport Information
Appearance
Safety WGK Germany 3
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Hexanoicacid, 6-(2,4-dinitroanilino)- (6CI,7CI,8CI);6-(2,4-Dinitroanilino)caproicacid;DNP-e-amino-n-caproic acid;Dinitrophenyl-e-aminocaproicacid;N-(2,4-Dinitrophenyl)-6-aminocaproic acid;N-(2,4-Dinitrophenyl)-e-aminocaproic acid;NSC 89627;[(2,4-Dinitrophenyl)amino]caproic acid;e-2,4-Dinitrophenylaminocaproic acid;
PSA 140.97000
LogP 3.67930

N-(2,4-Dinitrophenyl)-6-aminohexanoic acid Specification

The N-(2,4-Dinitrophenyl)-6-aminohexanoic acid with the cas number 10466-72-5 is also called Dnp-aminocaproic acid. The systematic name is Hexanoic acid, 6-((2,4-dinitrophenyl)amino)- and IUPAC name is 6-(2,4-dinitroanilino)hexanoic acid. This chemical is Ligand used in prosthetic-group-label immunoassay technique. It should be stored at −20°C.

Properties Computed from Structure: (1)XLogP3: 2.8; (2)H-Bond Donor: 2; (3)H-Bond Acceptor: 7; (4)Rotatable Bond Count: 7; (5)Exact Mass: 297.096085; (6)MonoIsotopic Mass: 297.096085; (7)Topological Polar Surface Area: 141; (8)Heavy Atom Count: 21; (9)Formal Charge: 0; (10)Complexity: 378; (11)Isotope Atom Count: 0; (12)Defined Atom StereoCenter Count: 0; (13)Undefined Atom StereoCenter Count: 0; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 1.

You can still convert the following datas into molecular structure:
(1)SMILES: c1([N+]([O-])=O)cc([N+]([O-])=O)ccc1NCCCCCC(=O)O
(2)InChI: InChI=1/C12H15N3O6/c16-12(17)4-2-1-3-7-13-10-6-5-9(14(18)19)8-11(10)15(20)21/h5-6,8,13H,1-4,7H2,(H,16,17)

Product Name

N-(2,4-DINITROPHENYL)-6-AMINOHEXANOIC ACID

N-(2,4-Dinitrophenyl)-6-aminohexanoic acid Specification

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