AC1M49FP structure

AC1M49FP

9-(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione

Also Known As: Oprea1_341150|Oprea1_835102|BAS 00548166|SR-01000415089-1|9-(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione|9-(3-iodo-5-methoxy-4-prop-2-ynyloxyphenyl)-3,3,6,6-tetramethyl-2,3,4,5,6,7-he xahydroxanthene-1,8-dione|9-[3-IODO-5-METHOXY-4-(PROP-2-YN-1-YLOXY)PHENYL]-3,3,6,6-TETRAMETHYL-2,3,4,5,6,7,8,9-OCTAHYDRO-1H-XANTHENE-1,8-DIONE|9-[3-iodo-5-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione

CAS: 328243-08-9
Molecular Formula C27H29IO5
Molecular Weight 560.10596 g/mol
LogP 5.712
Topological Polar Surface Area 61.83 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 560.10596
Monoisotopic Mass 560.10596
Heavy Atoms 33
Complexity 1093.7783

Chemical Identifiers

CAS Number 328243-08-9
SMILES CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C(=C4)I)OCC#C)OC)C(=O)C1)C

Product Overview

AC1M49FP (CAS 328243-08-9), with molecular formula C27H29IO5 and molecular weight 560.10596 g/mol. IUPAC: 9-(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione.

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