87-01-4

Name 7-Dimethylamino-4-methylcoumarin
CAS 87-01-4
EINECS(EC#) 201-717-3
Molecular Formula C12H13NO2
MDL Number MFCD00006862
Molecular Weight 203.24
MOL File 87-01-4.mol
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Chemical Properties

Melting point  144-146°C
Boiling point  341.55°C (rough estimate)
density  1.1255 (rough estimate)
refractive index  1.5260 (estimate)
storage temp.  Sealed in dry,Room Temperature
form  powder to crystal
pka 1.91±0.20(Predicted)
color  White to Light yellow to Green
InChI InChI=1S/C12H13NO2/c1-8-6-12(14)15-11-7-9(13(2)3)4-5-10(8)11/h4-7H,1-3H3
InChIKey GZEYLLPOQRZUDF-UHFFFAOYSA-N
SMILES C1(=O)OC2=CC(N(C)C)=CC=C2C(C)=C1
CAS DataBase Reference 87-01-4(CAS DataBase Reference)
NIST Chemistry Reference 4-Methyl-7-dimethylaminocoumarin(87-01-4)
EPA Substance Registry System 87-01-4(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S22:Do not breathe dust .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RTECS  GN6650000
TSCA  TSCA listed
HS Code  2932.20.4500
Toxicity
LD50 oral in mouse: 3890mg/kg

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