CAS 1134-94-7 | Benzenamine, 2-(phenylthio)- | CAS Number 1134-94-7

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1134-94-7 | Benzenamine, 2-(phenylthio)-

CAS No: 1134-94-7 Catalog No: AG0008FR MDL No:MFCD00190139

Product Description

Catalog Number:

AG0008FR

Chemical Name:

Benzenamine, 2-(phenylthio)-

CAS Number:

1134-94-7

Molecular Formula:

C12H11NS

Molecular Weight:

201.2874

MDL Number:

MFCD00190139

IUPAC Name:

2-phenylsulfanylaniline

InChI:

InChI=1S/C12H11NS/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H,13H2

InChI Key:

DGBISJKLNVVJGD-UHFFFAOYSA-N

SMILES:

Nc1ccccc1Sc1ccccc1

Properties

Complexity:

166

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

201.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

201.287g/mol

Monoisotopic Mass:

201.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3

Literature

Title	Journal
Identification and characterization of potential impurities of quetiapine fumarate.	Pharmaceutical development and technology 20090101
Trypanothione reductase: a viable chemotherapeutic target for antitrypanosomal and antileishmanial drug design.	Drug target insights 20070101
Diarylsulfones, a new chemical class of nonnucleoside antiviral inhibitors of human immunodeficiency virus type 1 reverse transcriptase.	Antimicrobial agents and chemotherapy 19930401