3-methyl-8-(2-phenylethanimidoyl)-4-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(2-phenylethanimidoyl)-4-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol

CAS: 73855-97-7

Molecular Formula	`C44H44N2O6`
Molecular Weight	696.8 g/mol
LogP	9.6
Topological Polar Surface Area	169.0 A2
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	8
Rotatable Bonds	9
Exact Mass	696.31995
Heavy Atoms	52
Complexity	1120.0

Chemical Identifiers

CAS Number	73855-97-7
SMILES	`CC1=C(C2=CC(=C(C(=C2C(=C1C3=C(C4=C(C(=C(C=C4C(=C3C)C(C)C)O)O)C(=N)CC5=CC=CC=C5)O)O)C(=N)CC6=CC=CC=C6)O)O)C(C)C`
InChIKey	`DJAIOJQQURHAHZ-UHFFFAOYSA-N`

📖 Product Overview

3-methyl-8-(2-phenylethanimidoyl)-4-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(2-phenylethanimidoyl)-4-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol (CAS: 73855-97-7) is a chemical compound with molecular formula C44H44N2O6 and molecular weight 696.8 g/mol. Its IUPAC systematic name is 3-methyl-8-(2-phenylethanimidoyl)-4-propan-2-yl-2-[1,6,7-trihydroxy-3-methyl-8-(2-phenylethanimidoyl)-4-propan-2-ylnaphthalen-2-yl]naphthalene-1,6,7-triol. LogP 9.6 Topological Polar Surface Area 169.0 A2 Hydrogen Bond Donors 8 Hydrogen Bond Acceptors 8 Rotatable Bonds 9 Exact Mass 696.31995 Heavy Atoms 52 Complexity 1120.0 InChI Key: DJAIOJQQURHAHZ-UHFFFAOYSA-N. SMILES: CC1=C(C2=CC(=C(C(=C2C(=C1C3=C(C4=C(C(=C(C=C4C(=C3C)C(C)C)O)O)C(=N)CC5=CC=CC=C5)O)O)C(=N)CC6=CC=CC=C6)O)O)C(C)C.

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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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