chempirical

4-Methyl-7-diethylaminocoumarin

C14H17NO2CAS 91-44-1231.29 g/mol

Open in Covalent MOL file
NOO
Tertiary amine

Properties

Molecular formula
C14H17NO2
Molar mass
231.29 g/mol
Exact mass
231.1259 Da
Melting point
89 °C
logP
2.95Crippen estimate
Polar surface area
33.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

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
91-44-1
SMILES
CCN(CC)c1ccc2c(C)cc(=O)oc2c1
InChIKey
AFYCEAFSNDLKSX-UHFFFAOYSA-N
InChI
InChI=1S/C14H17NO2/c1-4-15(5-2)11-6-7-12-10(3)8-14(16)17-13(12)9-11/h6-9H,4-5H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

48 names · show all
  • Coumarin 1
  • 2H-1-Benzopyran-2-one, 7-(diethylamino)-4-methyl-
  • Coumarin, 7-(diethylamino)-4-methyl-
  • 7-(Diethylamino)-4-methyl-2H-1-benzopyran-2-one
  • 4-Methyl-7-(diethylamino)coumarin
  • 7-(Diethylamino)-4-methylcoumarin
  • Coumarin 460
  • Calcofluor white RW
  • Blancophor AW
  • Blancophor FFG
  • Uvitex WGS
  • MDAC
  • Hiltamine arctic white SOL
  • Aclarat 8678
  • Calcofluor white SD
  • 7D4MC
  • Hakkol P
  • Coumarin 47
  • C 47
  • DEMC
  • C 47 (Coumarin derivative)
  • Blankophor SOL
  • Fluorescent brightener 140
  • C.I. 551100
  • C.I. Fluorescent brightener 140
  • Rylux VPA
  • Tinopal SWN
  • Uvitex SWN
  • C.I. Fluorescent brightener 52
  • Blancol WNS
  • Kayaphor WN
  • Leucophor WS
  • Leukophor WS
  • Fluorescent brightener 52
  • Whitex WS
  • Whitefluor B
  • neo-Super HR 1
  • HR 1
  • NSC 61830
  • C.I. Fluorescent brightening agent 52
  • Rylux VPA-T
  • Diethylamino-4-methylcoumarin
  • NF-MC
  • Optiblanc SPL 10
  • 7-(Diethylamino)-4-methyl-2H-chromen-2-one
  • Calcofluor RW
  • Brightener SWN
  • 7-Diethylamino-4-methylbenzopyran-2-one

Work with 4-Methyl-7-diethylaminocoumarin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

DAMC87-01-468 % similar 7-Ethoxy-4-methylcoumarin87-05-856 % similar 7-Amino-4-methylcoumarin26093-31-255 % similar 4-Methylumbelliferone90-33-555 % similar 4-Methylcoumarin607-71-653 % similar 7-Methoxy-4-methylcoumarin2555-28-452 % similar O,O-Diethyl O-(4-methyl-2-oxo-2H-1-benzopyran-7-yl) phosphorothioate299-45-647 % similar 4-Methylumbelliferyl acetate2747-05-947 % similar

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

Same formula

1-Cbz-4-methylene-piperidine138163-12-9 7-Benzyl-3-oxa-7-azabicyclo[3.3.1]nonan-9-one77716-01-9

Elsewhere

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