N-Benzenesulfenylcarbofuran

(2,2-dimethyl-3H-1-benzofuran-7-yl) N-methyl-N-phenylsulfanylcarbamate

CAS: 50539-66-7

Molecular Formula	`C18H19NO3S`
Molecular Weight	329.4 g/mol
LogP	3.7
Topological Polar Surface Area	64.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	4
Exact Mass	329.10855
Heavy Atoms	23
Complexity	422.0

Chemical Identifiers

CAS Number	50539-66-7
SMILES	`CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC=CC=C3)C`
InChIKey	`AGAFDJJQJCSMQQ-UHFFFAOYSA-N`

📖 Product Overview

N-Benzenesulfenylcarbofuran (CAS: 50539-66-7) is a chemical compound with molecular formula C18H19NO3S and molecular weight 329.4 g/mol. Its IUPAC systematic name is (2,2-dimethyl-3H-1-benzofuran-7-yl) N-methyl-N-phenylsulfanylcarbamate. LogP 3.7 Topological Polar Surface Area 64.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 4 Exact Mass 329.10855 Heavy Atoms 23 Complexity 422.0 InChI Key: AGAFDJJQJCSMQQ-UHFFFAOYSA-N. SMILES: CC1(CC2=C(O1)C(=CC=C2)OC(=O)N(C)SC3=CC=CC=C3)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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