94265-96-0
(4AA,7A,8AB)-1H-2-BENZOPYRAN,3,4,4A,7,8,8A-HEXAHYDRO-3,3,6,7-TETRAMETHYL-
Name(4AA,7A,8AB)-1H-2-BENZOPYRAN,3,4,4A,7,8,8A-HEXAHYDRO-3,3,6,7-TETRAMETHYL-
1Identification
【Name】
(4AA,7A,8AB)-1H-2-BENZOPYRAN,3,4,4A,7,8,8A-HEXAHYDRO-3,3,6,7-TETRAMETHYL-
【CAS】
【MDL】
MFCD21608209
【English Synonyms】
(4AA,7A,8AB)-1H-2-BENZOPYRAN,3,4,4A,7,8,8A-HEXAHYDRO-3,3,6,7-TETRAMETHYL-
1H-2-BENZOPYRAN,3,4,4A,7,8,8A-HEXAHYDRO-3,3,6,7-TETRAMETHYL-, (4AA,7A,8AB)-
【Formula】
C13 H22 O
【MolWeight】
194.316
【Inchi】
InChI=1S/C13H22O/c1-9-5-11-7-13(3,4)14-8-12(11)6-10(9)2/h5,10-12H,6-8H2,1-4H3/t10-,11-,12-/m1/s1
【InChIKey】
InChIKey=HIHXXYCXFIAFGQ-IJLUTSLNSA-N
【SMILES】
C[C@@H]1C[C@@H]2COC(C[C@H]2C=C1C)(C)C
【MOL File】
(4AA,7A,8AB)-1H-2-BE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(4AA,7A,8AB)-1H-2-BENZOPYRAN,3,4,4A,7,8,8A-HEXAHYDRO-3,3,6,7-TETRAMETHYL-.cml