(2,2-dimethyl-3H-1-benzofuran-7-yl) N-[(4-bromo-2-methylphenyl)sulfanylmethyl]carbamate

CAS: 50539-75-8

Molecular Formula	`C19H20BrNO3S`
Molecular Weight	422.3 g/mol
LogP	5.7
Topological Polar Surface Area	72.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	421.03473
Heavy Atoms	25
Complexity	476.0

Chemical Identifiers

CAS Number	50539-75-8
SMILES	`CC1=C(C=CC(=C1)Br)SCNC(=O)OC2=CC=CC3=C2OC(C3)(C)C`
InChIKey	`GYCLESUXOHBCRE-UHFFFAOYSA-N`

📖 Product Overview

(2,2-dimethyl-3H-1-benzofuran-7-yl) N-[(4-bromo-2-methylphenyl)sulfanylmethyl]carbamate (CAS: 50539-75-8) is a chemical compound with molecular formula C19H20BrNO3S and molecular weight 422.3 g/mol. Its IUPAC systematic name is (2,2-dimethyl-3H-1-benzofuran-7-yl) N-[(4-bromo-2-methylphenyl)sulfanylmethyl]carbamate. LogP 5.7 Topological Polar Surface Area 72.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 421.03473 Heavy Atoms 25 Complexity 476.0 InChI Key: GYCLESUXOHBCRE-UHFFFAOYSA-N. SMILES: CC1=C(C=CC(=C1)Br)SCNC(=O)OC2=CC=CC3=C2OC(C3)(C)C.

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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 (2,2-dimethyl-3H-1-benzofuran-7-yl) N-[(4-bromo-2-methylphenyl)sulfanylmethyl]carbamate.

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