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N-(4-Aminophenyl)-4-methylbenzenesulfonamide

N-(4-Aminophenyl)-4-methylbenzenesulfonamide - CAS 6380-08-1

Catalog:	BB032281
Product Name:	N-(4-Aminophenyl)-4-methylbenzenesulfonamide
CAS:	6380-08-1
Synonyms:	N-(4-aminophenyl)-4-methylbenzenesulfonamide

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Computed Properties

IUPAC Name:	N-(4-aminophenyl)-4-methylbenzenesulfonamide
Description:	N-(4-Aminophenyl)-4-methylbenzenesulfonamide (CAS# 6380-08-1) is a useful research chemical compound.
Molecular Weight:	262.33
Molecular Formula:	C13H14N2O2S
Canonical SMILES:	CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N
InChI:	InChI=1S/C13H14N2O2S/c1-10-2-8-13(9-3-10)18(16,17)15-12-6-4-11(14)5-7-12/h2-9,15H,14H2,1H3
InChI Key:	XKDFMOOUKPSLEM-UHFFFAOYSA-N
Boiling Point:	453.7 °C at 760 mmHg
Density:	1.33 g/cm³
Appearance:	White to dark brown solid
MDL:	MFCD00134366
LogP:	4.11300

Publication Number	Title	Priority Date
CN-108148005-B	O-aminophenol derivatives and preparation method thereof	20180118
EP-3438091-A1	Compound having enhancing activity for glucagon-like peptide-1 receptor actions	20160330
JP-WO2017170826-A1	Compounds having glucagon-like peptide-1 receptor activity enhancing activity	20160330
US-2019022039-A1	Compound having enhancing activity for glucagon-like peptide-1 receptor actions	20160330
US-2020129458-A1	Compound having enhancing activity for glucagon-like peptide-1 receptor actions	20160330

PMID	Publication Date	Title	Journal
22064752	20111001	N-(4-Amino-phen-yl)-4-methylbenzene-sulfonamide	Acta crystallographica. Section E, Structure reports online

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Related Functional Groups

Sulfur Compounds

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[862649-86-3]
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[874-87-3]
4-(Methylthio)benzyl chloride
[15863-41-9]
4-(Methylthio)phenyl isothiocyanate

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	348
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	262.07759887
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	262.07759887
Rotatable Bond Count:	3
Topological Polar Surface Area:	80.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1