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4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 1-methyl-2-(1-piperidinyl)ethyl ester, hydrochloride, hydrate

Base Information
  • Chemical Name:4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 1-methyl-2-(1-piperidinyl)ethyl ester, hydrochloride, hydrate
  • CAS No.:86433-61-6
  • Molecular Formula:C25H28ClNO4
  • Molecular Weight:441.9471
  • Hs Code.:
  • DSSTox Substance ID:DTXSID601006841
4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 1-methyl-2-(1-piperidinyl)ethyl ester, hydrochloride, hydrate

Synonyms:1-Methyl-2-piperidinoethyl 3-methyl-4-oxo-2-phenyl-3H-1-benzopyran-8-carboxylate HCl H2O;4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 1-methyl-2-(1-piperidinyl)ethyl ester, hydrochloride, hydrate;86433-61-6;C25H27NO4.ClH.H2O;DTXSID601006841;C25-H27-N-O4.Cl-H.H2-O;LS-39206;1-(Piperidin-1-yl)propan-2-yl 3-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxylate--hydrogen chloride (1/1)

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Chemical Property of 4H-1-Benzopyran-8-carboxylic acid, 3-methyl-4-oxo-2-phenyl-, 1-methyl-2-(1-piperidinyl)ethyl ester, hydrochloride, hydrate
Chemical Property:
  • Vapor Pressure:6.25E-13mmHg at 25°C 
  • Boiling Point:568.3°Cat760mmHg 
  • Flash Point:297.5°C 
  • Density:g/cm3 
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:6
  • Exact Mass:441.1706861
  • Heavy Atom Count:31
  • Complexity:660
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OC(C)CN3CCCCC3)C4=CC=CC=C4.Cl
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