BRN 1092506

2-[5-(4-chlorobenzoyl)-6-methyl-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid

CAS: 37585-47-0

Molecular Formula	`C19H14ClNO5`
Molecular Weight	371.8 g/mol
LogP	4.1
Topological Polar Surface Area	77.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	371.05606
Heavy Atoms	26
Complexity	564.0

Chemical Identifiers

CAS Number	37585-47-0
SMILES	`CC1=C(C2=CC3=C(C=C2N1C(=O)C4=CC=C(C=C4)Cl)OCO3)CC(=O)O`
InChIKey	`UNJXYKQUBNUFDO-UHFFFAOYSA-N`

📖 Product Overview

BRN 1092506 (CAS: 37585-47-0) is a chemical compound with molecular formula C19H14ClNO5 and molecular weight 371.8 g/mol. Its IUPAC systematic name is 2-[5-(4-chlorobenzoyl)-6-methyl-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid. LogP 4.1 Topological Polar Surface Area 77.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 371.05606 Heavy Atoms 26 Complexity 564.0 InChI Key: UNJXYKQUBNUFDO-UHFFFAOYSA-N. SMILES: CC1=C(C2=CC3=C(C=C2N1C(=O)C4=CC=C(C=C4)Cl)OCO3)CC(=O)O.

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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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