1-(4-Hydroxy-2,2-Dimethylchroman-6-Yl)Ethanone

CAS	1890153-71-5
Synonyms	Ethanone, 1-[(4S)-3,4-dihydro-4-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl]-
IUPAC Name	1-(4-Hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)ethanone
Molecular Weight	220.26
Molecular Formula	C13H16O3
Canonical SMILES	CC(=O)C1=CC2=C(C=C1)OC(CC2O)(C)C
InChI	InChI=1S/C13H16O3/c1-8(14)9-4-5-12-10(6-9)11(15)7-13(2,3)16-12/h4-6,11,15H,7H2,1-3H3
InChI Key	RNNQKZPVFGNIMY-UHFFFAOYSA-N
Boiling Point	362.0±42.0 °C
Purity	98%
Density	1.133±0.06 g/ml
pKa	13.87±0.40
Appearance	Solid