480-33-1
(3R)-8-HYDROXY-3-METHYL-3,4-DIHYDRO-1H-2-BENZOPYRAN-1-ONE
Name(3R)-8-HYDROXY-3-METHYL-3,4-DIHYDRO-1H-2-BENZOPYRAN-1-ONE
1Identification
【Name】
(3R)-8-HYDROXY-3-METHYL-3,4-DIHYDRO-1H-2-BENZOPYRAN-1-ONE
【CAS】
【MDL】
MFCD22199813
【English Synonyms】
【Formula】
C10 H10 O3
【MolWeight】
178.186
【Inchi】
InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3/t6-/m1/s1
【InChIKey】
InChIKey=KWILGNNWGSNMPA-ZCFIWIBFSA-N
【SMILES】
C[C@@H]1Cc2cccc(c2C(=O)O1)O
【MOL File】
(3R)-8-HYDROXY-3-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3R)-8-HYDROXY-3-METHYL-3,4-DIHYDRO-1H-2-BENZOPYRAN-1-ONE.cml