CTK3I7725 structure

CTK3I7725

1-aminopropan-2-ol;ethane-1,2-diol;3-(5-methylocta-2,4,6-trien-4-yl)-4-prop-1-enyloxolane-2,5-dione

Also Known As: (C16-H26-O3.C3-H9-N-O.C2-H6-O2)x-|2,5-Furandione, dihydro-3-(tetrapropenyl)-, polymer with 1-amino-2-propanol and 1,2-ethanediol|1-aminopropan-2-ol; ethane-1,2-diol; 3-[(2E,4Z,6E)-5-methylocta-2,4,6-trien-4-yl]-4-[(E)-prop-1-enyl]oxolane-2,5-dione

CAS: 9060-53-1
Molecular Formula C21H35NO6
Molecular Weight 397.24643 g/mol
LogP 1.6439
Topological Polar Surface Area 130.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 397.24643
Monoisotopic Mass 397.24643
Heavy Atoms 28
Complexity 507.0

Chemical Identifiers

CAS Number 9060-53-1
SMILES CC=CC1C(C(=O)OC1=O)C(=C(C)C=CC)C=CC.CC(CN)O.C(CO)O
InChIKey FFFKNLCSFAPFHY-UHFFFAOYSA-N

Product Overview

CTK3I7725 (CAS 9060-53-1), with molecular formula C21H35NO6 and molecular weight 397.24643 g/mol. IUPAC: 1-aminopropan-2-ol;ethane-1,2-diol;3-(5-methylocta-2,4,6-trien-4-yl)-4-prop-1-enyloxolane-2,5-dione.

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