BRN 1401552

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

CAS: 50539-70-3

Molecular Formula	`C22H27NO3S`
Molecular Weight	385.5 g/mol
LogP	6.3
Topological Polar Surface Area	72.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	385.17117
Heavy Atoms	27
Complexity	508.0

Chemical Identifiers

CAS Number	50539-70-3
SMILES	`CC1(CC2=C(O1)C(=CC=C2)OC(=O)NCSC3=CC=C(C=C3)C(C)(C)C)C`
InChIKey	`BPFWPAYVFBBACO-UHFFFAOYSA-N`

📖 Product Overview

BRN 1401552 (CAS: 50539-70-3) is a chemical compound with molecular formula C22H27NO3S and molecular weight 385.5 g/mol. Its IUPAC systematic name is (2,2-dimethyl-3H-1-benzofuran-7-yl) N-[(4-tert-butylphenyl)sulfanylmethyl]carbamate. LogP 6.3 Topological Polar Surface Area 72.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 385.17117 Heavy Atoms 27 Complexity 508.0 InChI Key: BPFWPAYVFBBACO-UHFFFAOYSA-N. SMILES: CC1(CC2=C(O1)C(=CC=C2)OC(=O)NCSC3=CC=C(C=C3)C(C)(C)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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