NSC39484 structure

NSC39484

methyl 3-[8,13-dicyano-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate

Also Known As: Dimethyl 3,3'-(7,12-dicyano-3,8,13,17-tetramethylporphyrin-2,18-diyl)dipropanoate|methyl 3-[7,12-dicyano-18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate|methyl 3-[8,13-dicyano-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate

CAS: 7253-86-3
Molecular Formula C34H32N6O4
Molecular Weight 588.2485 g/mol
LogP 3.2
Topological Polar Surface Area 158.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 8
Exact Mass 588.2485
Monoisotopic Mass 588.2485
Heavy Atoms 44
Complexity 1150.0

Chemical Identifiers

CAS Number 7253-86-3
SMILES CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C#N)C)C(=C4CCC(=O)OC)C)C(=C3C)CCC(=O)OC)C#N
InChIKey GCYLRWYOAVMGKS-UHFFFAOYSA-N

Product Overview

NSC39484 (CAS 7253-86-3), with molecular formula C34H32N6O4 and molecular weight 588.2485 g/mol. IUPAC: methyl 3-[8,13-dicyano-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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