2-[4-[[(4-fluorophenyl)azaniumylidene-phenylmethyl]amino]phenoxy]ethyl-di(propan-2-yl)azanium dibromide

CAS: 80785-17-7

Molecular Formula	`C27H34Br2FN3O`
Molecular Weight	595.4 g/mol
Topological Polar Surface Area	39.7 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	10
Exact Mass	595.1032
Heavy Atoms	34
Complexity	537.0

Chemical Identifiers

CAS Number	80785-17-7
SMILES	`CC(C)[NH+](CCOC1=CC=C(C=C1)NC(=[NH+]C2=CC=C(C=C2)F)C3=CC=CC=C3)C(C)C.[Br-].[Br-]`
InChIKey	`HFKDIJWXCBQSQP-UHFFFAOYSA-N`

📖 Product Overview

2-[4-[[(4-fluorophenyl)azaniumylidene-phenylmethyl]amino]phenoxy]ethyl-di(propan-2-yl)azanium dibromide (CAS: 80785-17-7) is a chemical compound with molecular formula C27H34Br2FN3O and molecular weight 595.4 g/mol. Its IUPAC systematic name is 2-[4-[[(4-fluorophenyl)azaniumylidene-phenylmethyl]amino]phenoxy]ethyl-di(propan-2-yl)azanium dibromide. Topological Polar Surface Area 39.7 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 595.1032 Heavy Atoms 34 Complexity 537.0 InChI Key: HFKDIJWXCBQSQP-UHFFFAOYSA-N. SMILES: CC(C)[NH+](CCOC1=CC=C(C=C1)NC(=[NH+]C2=CC=C(C=C2)F)C3=CC=CC=C3)C(C)C.[Br-].[Br-].

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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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Frequently Asked Questions

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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 2-[4-[[(4-fluorophenyl)azaniumylidene-phenylmethyl]amino]phenoxy]ethyl-di(propan-2-yl)azanium dibromide.

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