845962-06-3
FURO[4,3,2-DE][1]BENZOPYRAN, 5A,6,7,8-TETRAHYDRO-3-METHYL-, (5AR)-
NameFURO[4,3,2-DE][1]BENZOPYRAN, 5A,6,7,8-TETRAHYDRO-3-METHYL-, (5AR)-
1Identification
【Name】
FURO[4,3,2-DE][1]BENZOPYRAN, 5A,6,7,8-TETRAHYDRO-3-METHYL-, (5AR)-
【CAS】
【MDL】
MFCD17017889
【English Synonyms】
【Formula】
C11 H12 O2
【MolWeight】
176.214
【Inchi】
InChI=1S/C11H12O2/c1-7-5-12-9-3-2-4-10-11(9)8(7)6-13-10/h5-6,9H,2-4H2,1H3/t9-/m1/s1
【InChIKey】
InChIKey=VMKWOGWTCXYGOS-SECBINFHSA-N
【SMILES】
CC1=CO[C@@H]2CCCc3c2c1co3
【MOL File】
FURO[4,3,2-DE][1]BEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
FURO[4,3,2-DE][1]BENZOPYRAN, 5A,6,7,8-TETRAHYDRO-3-METHYL-, (5AR)-.cml