2-(hydroxymethyl)-4,5,6,7-tetrahydroisoindole-1,3-dione

CAS: 4887-42-7

Molecular Formula	`C9H11NO3`
Molecular Weight	181.19 g/mol
LogP	1.1
Topological Polar Surface Area	57.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	181.0739
Heavy Atoms	13
Complexity	278.0

Chemical Identifiers

CAS Number	4887-42-7
SMILES	`C1CCC2=C(C1)C(=O)N(C2=O)CO`
InChIKey	`QQHOVRKETYPQHY-UHFFFAOYSA-N`

📖 Product Overview

2-(hydroxymethyl)-4,5,6,7-tetrahydroisoindole-1,3-dione (CAS: 4887-42-7) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.19 g/mol. Its IUPAC systematic name is 2-(hydroxymethyl)-4,5,6,7-tetrahydroisoindole-1,3-dione. LogP 1.1 Topological Polar Surface Area 57.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 1 Exact Mass 181.0739 Heavy Atoms 13 Complexity 278.0 InChI Key: QQHOVRKETYPQHY-UHFFFAOYSA-N. SMILES: C1CCC2=C(C1)C(=O)N(C2=O)CO.

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