alpha-Naphtholphthalein

3,3-bis(4-hydroxynaphthalen-1-yl)-2-benzofuran-1-one

CAS: 596-01-0

Molecular Formula	`C28H18O4`
Molecular Weight	418.4 g/mol
LogP	6.3
Topological Polar Surface Area	66.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	418.1205
Heavy Atoms	32
Complexity	668.0

Chemical Identifiers

CAS Number	596-01-0
SMILES	`C1=CC=C2C(=C1)C(=CC=C2O)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C6=CC=CC=C65)O`
InChIKey	`HQHBAGKIEAOSNM-UHFFFAOYSA-N`

📖 Product Overview

alpha-Naphtholphthalein (CAS: 596-01-0) is a chemical compound with molecular formula C28H18O4 and molecular weight 418.4 g/mol. Its IUPAC systematic name is 3,3-bis(4-hydroxynaphthalen-1-yl)-2-benzofuran-1-one. LogP 6.3 Topological Polar Surface Area 66.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 418.1205 Heavy Atoms 32 Complexity 668.0 InChI Key: HQHBAGKIEAOSNM-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(=CC=C2O)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C6=CC=CC=C65)O.

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