945632-79-1

Basic information

• Product Name: Propanedioic acid, 2-(acetylaMino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, 1,3-diethyl ester
• Synonyms: Propanedioic acid, 2-(acetylaMino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, 1,3-diethyl ester;Diethyl 2-acetamido-2-(6-octyl-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)malonate
• CAS NO: 945632-79-1
• Molecular Formula: C27H39NO6
• Molecular Weight: 473.60166
• Mol File: 945632-79-1.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 603.1±55.0 °C(Predicted)
• Appearance: /
• Density: 1 +-.0.06 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• PKA: 11.49±0.46(Predicted)
• CAS DataBase Reference: Propanedioic acid, 2-(acetylaMino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, 1,3-diethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: Propanedioic acid, 2-(acetylaMino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, 1,3-diethyl ester(945632-79-1)
• EPA Substance Registry System: Propanedioic acid, 2-(acetylaMino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, 1,3-diethyl ester(945632-79-1)

Safety Data

• Hazardous Substances Data: 945632-79-1(Hazardous Substances Data)

Upstream product

• 1068-90-2 2-acetylaminomalonic acid diethyl ester 
• 144464-64-2 5-oxo-5,6,7,8-tetrahydronaphthalen-2-yl trifluoromethanesulfonate 
• 3470-50-6 6-Hydroxy-1-tetralone 
• 945632-75-7 6-octyl-3,4-dihydro-2H-naphthalen-1-one 
• 945632-77-9 2-bromo-6-octyl-3,4-dihydro-2H-naphthalen-1-one 
• 30412-43-2 sodium diethylacetamidomalonate 

Downstream Products

• 945632-81-5 2-acetylamino-2-(6-octyl-1,2,3,4-tetrahydro-naphthalen-2-yl)-malonic acid diethyl ester 
• 945632-52-0 2-amino-2-(6-octyl-1,2,3,4-tetrahydro-naphthalen-2-yl)propane-1,3-diol 
• 1118948-68-7 N-[2-hydroxy-1-hydroxymethyl-1-(6-octyl-1,2,3,4-tetrahydro-naphthalen-2-yl)ethyl]-acetamide 

Relevant articles and documents

Stereochemistry-activity relationship of orally active tetralin S1P agonist prodrugs

Modifying FTY720, an immunosuppressant modulator, led to a new series of well phosphorylated tetralin analogs as potent S1P1 receptor agonists. The stereochemistry effect of tetralin ring was probed, and (-)-(R)-2-amino-2-((S)-6-octyl-1,2,3,4-tetrahydrona

BICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS

Compounds that have agonist activity at one or more of the S1P receptors are provided. The compounds are sphingosine analogs that, after phosphorylation, can behave as agonists at S1P receptors.