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861960-34-1

Name 7-METHOXY-3,4-DIHYDRO-1-NAPHTHALENYL-ACETONITRILE
CAS 861960-34-1
EINECS(EC#) 617-813-7
Molecular Formula C13H13NO
MDL Number MFCD09840884
Molecular Weight 199.248
MOL File 861960-34-1.mol
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Chemical Properties

Appearance White Solid
Melting point  41-43°C
Boiling point  349.6±42.0 °C(Predicted)
density  1.091±0.06 g/cm3(Predicted)
vapor pressure  0.001Pa at 25℃
storage temp.  Refrigerator
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly)
form  Solid
color  Off-White
InChI InChI=1S/C13H13NO/c1-15-12-6-5-10-3-2-4-11(7-8-14)13(10)9-12/h4-6,9H,2-3,7H2,1H3
InChIKey MGJHVZKRAOYORH-UHFFFAOYSA-N
SMILES C1(CC#N)C2=C(C=CC(OC)=C2)CCC=1
LogP 2.42 at 30℃ and pH6.6
CAS DataBase Reference 861960-34-1

Safety Data

HS Code  2926907090

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