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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP022066

4-Phenylbutyl isothiocyanate

Formula: C11H13NS  |  Mol. Weight: 191.29 g/mol

IUPAC: 4-isothiocyanatobutylbenzene

Overview

Molecular Formula C11H13NS
Molecular Weight 191.29 g/mol
Canonical SMILES C1=CC=C(C=C1)CCCCN=C=S

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy