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C20H21NO5CAS 73080-51-0355.39 g/mol

Open in Covalent MOL file
NOHOOOO
EsterPhenol

Properties

Molecular formula
C20H21NO5
Molar mass
355.39 g/mol
Exact mass
355.1420 Da
Melting point
236–241 °C
logP
3.87Crippen estimate
Polar surface area
89.6 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
73080-51-0
SMILES
Cc1ccc2c(nc(O)c3c(=O)cc(C(=O)OCCC(C)C)oc32)c1C
InChIKey
NFQIAEMCQGTTIR-UHFFFAOYSA-N
InChI
InChI=1S/C20H21NO5/c1-10(2)7-8-25-20(24)15-9-14(22)16-18(26-15)13-6-5-11(3)12(4)17(13)21-19(16)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,23)

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Names and synonyms

3 names
  • 4H-Pyrano[3,2-c]quinoline-2-carboxylic acid, 5,6-dihydro-7,8-dimethyl-4,5-dioxo-, 3-methylbutyl ester
  • MY 5116
  • Romet

Work with Repirinast

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Similar compounds

Isoamyl salicylate87-20-737 % similar Isoamyl benzoate94-46-233 % similar Isoamyl 4-N,N-dimethylaminobenzoate21245-01-231 % similar Diisodecyl phthalate26761-40-030 % similar Diisooctyl phthalate27554-26-330 % similar Diisononyl phthalate28553-12-030 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Fmoc-N-amido-peg1-acid1654740-73-4

Elsewhere

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