ChemicalBook--->CAS DataBase List--->13728-56-8

13728-56-8

13728-56-8 Structure

13728-56-8 Structure
IdentificationBack Directory
[Name]

4-(3-phenanthryl)butanoic acid
[CAS]

13728-56-8
[Synonyms]

NSC-92828
HIV-1 Nef-IN-1
4-(3-phenanthryl)butanoic acid
[Molecular Formula]

C18H16O2
[MDL Number]

MFCD30741763
[MOL File]

13728-56-8.mol
[Molecular Weight]

264.32
Chemical PropertiesBack Directory
[Melting point ]

138-139 °C
[Boiling point ]

487.2±14.0 °C(Predicted)
[density ]

1.211±0.06 g/cm3(Predicted)
[solubility ]

Chloroform (Slightly), DMSO (Slightly)
[form ]

Solid
[pka]

4.76±0.10(Predicted)
[color ]

Pale Yellow ti Light Yellow
[InChI]

InChI=1S/C18H16O2/c19-18(20)7-3-4-13-8-9-15-11-10-14-5-1-2-6-16(14)17(15)12-13/h1-2,5-6,8-12H,3-4,7H2,(H,19,20)
[InChIKey]

NYIVWTWKIQOBKO-UHFFFAOYSA-N
[SMILES]

C1=C2C(C3C(C=C2)=CC=CC=3)=CC(CCCC(O)=O)=C1
Hazard InformationBack Directory
[Uses]

3-Phenanthrenebutanoic Acid is an intermediate in the synthesis of novel polycyclic aromatic isomers of benz[a]anthracene containing a cyclopenta-fused ring.
[IC 50]

HIV-1 Nef: 6.7 μM (Kd)
Spectrum DetailBack Directory
[Spectrum Detail]

4-(3-phenanthryl)butanoic acid(13728-56-8)1HNMR
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