7-Chloro-1,3-dihydro-1-methyl-3-hydroxy-5-(2-fluorophenyl)-2H-1,4-benzodiazepin-2-one

7-chloro-5-(2-fluorophenyl)-3-hydroxy-1-methyl-3H-1,4-benzodiazepin-2-one

CAS: 52391-89-6

Molecular Formula	`C16H12ClFN2O2`
Molecular Weight	318.73 g/mol
LogP	2.3
Topological Polar Surface Area	52.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	318.05713
Heavy Atoms	22
Complexity	473.0

Chemical Identifiers

CAS Number	52391-89-6
SMILES	`CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)O)C3=CC=CC=C3F`
InChIKey	`RMFYWNFETXNTIQ-UHFFFAOYSA-N`

📖 Product Overview

7-Chloro-1,3-dihydro-1-methyl-3-hydroxy-5-(2-fluorophenyl)-2H-1,4-benzodiazepin-2-one (CAS: 52391-89-6) is a chemical compound with molecular formula C16H12ClFN2O2 and molecular weight 318.73 g/mol. Its IUPAC systematic name is 7-chloro-5-(2-fluorophenyl)-3-hydroxy-1-methyl-3H-1,4-benzodiazepin-2-one. LogP 2.3 Topological Polar Surface Area 52.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 318.05713 Heavy Atoms 22 Complexity 473.0 InChI Key: RMFYWNFETXNTIQ-UHFFFAOYSA-N. SMILES: CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)O)C3=CC=CC=C3F.

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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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📚 Academic Support

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 7-Chloro-1,3-dihydro-1-methyl-3-hydroxy-5-(2-fluorophenyl)-2H-1,4-benzodiazepin-2-one.

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