1036-49-3

Name (S)-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-7,8-dihydroxy-4H-1-benzopyran-4-one
CAS 1036-49-3
Molecular Formula C15H12O6
MDL Number MFCD32862565
Molecular Weight 288.25
MOL File 1036-49-3.mol
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Chemical Properties

Melting point  126-127 °C
Boiling point  627.9±55.0 °C(Predicted)
density  1.586±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
form  Solid
pka 7.54±0.40(Predicted)
color  Off-white to light yellow
InChI InChI=1S/C15H12O6/c16-9-3-1-7(5-12(9)19)13-6-11(18)8-2-4-10(17)14(20)15(8)21-13/h1-5,13,16-17,19-20H,6H2/t13-/m0/s1
InChIKey ZPVNWCMRCGXRJD-ZDUSSCGKSA-N
SMILES [C@H]1(C2=CC=C(O)C(O)=C2)OC2=C(O)C(O)=CC=C2C(=O)C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319
Precautionary statements  P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330

Hazard Information

Spectrum Detail

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