Methyl isoindoline-5-carboxylate hydrochloride

Base Information

• Chemical Name: Methyl isoindoline-5-carboxylate hydrochloride
• CAS No.: 127168-93-8
• Molecular Formula: C10H12ClNO2
• Molecular Weight: 213.66100
• Hs Code.: 2933990090
• European Community (EC) Number: 817-408-7
• DSSTox Substance ID: DTXSID70600394
• Mol file: 127168-93-8.mol

Synonyms:METHYL ISOINDOLINE-5-CARBOXYLATE HYDROCHLORIDE;127168-93-8;methyl 2,3-dihydro-1H-isoindole-5-carboxylate hydrochloride;METHYL ISOINDOLINE-5-CARBOXYLATE HCL;methyl 2,3-dihydro-1H-isoindole-5-carboxylate;hydrochloride;2,3-Dihydro-1H-isoindole-5-carboxylic acid methyl ester hydrochloride;1H-Isoindole-5-carboxylic acid, 2,3-dihydro-, methyl ester, hydrochloride (1:1);MFCD10699381;Methylisoindoline-5-carboxylatehydrochloride;SCHEMBL1263024;DTXSID70600394;UCJNRYHJEDJKAI-UHFFFAOYSA-N;SC4430;AKOS015920379;MB08786;5-methoxycarbonylisoindoline hydrochloride;AS-54674;DA-46477;SY043042;AM20020359;CS-0049192;EN300-71309;A846777;J-522612;F1993-0040;Z1575143744;2,3-Dihydro-1H-isoindole-5-carboxylic acid methyl ester hydrochloride salt;Methyl 2,3-dihydro-1H-isoindole-5-carboxylate--hydrogen chloride (1/1);1H-Isoindole-5-carboxylic acid, 2,3-dihydro-,methyl ester, hydrochloride (1:1);Methyl isoindoline-5-carboxylate hcl;Methyl isoindoline-5-carboxylate hydrochloride;2,3-Dihydro-1H-isoindole-5-carboxylic Acid Methyl Ester Monohydrochloride;5-(Methoxycarbonyl)isoindoline Hydrochloride

Chemical Property of Methyl isoindoline-5-carboxylate hydrochloride

Chemical Property:

• PSA: 38.33000
• LogP: 2.20720
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 213.0556563
• Heavy Atom Count: 14
• Complexity: 205

Purity/Quality:

99%, ^*data from raw suppliers

MethylIsoindoline-5-carboxylateHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC2=C(CNC2)C=C1.Cl
• Uses: Methyl isoindoline-5-carboxylate Hydrochloride (CAS# 127168-93-8) is used as a reagent in the preparation method of azabicyclooctane derivatives, used as FXR inhibitors.

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