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Dehydrothio-p-toluidine

CAT: 0957-E7273-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0957-E7273-100mgSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
92-36-4
Synonyms
DHPT
Additionnal Information
Dehydrothio-p-toluidine (DHPT) is a chemical intermediate used in dyestuff production. Dehydrothio-p-toluidine shows inhalation toxicity in acute and subchronic conditions.
Storage Conditions
3 years-20°C powder 2 years-80°C in solvent

Chemical Information

2-(4-Aminophenyl)-6-methylbenzothiazole

2-(4-aminophenyl)-6-methylbenzothiazole appears as light tan or light orange powder. Solutions have a violet-blue fluorescence. (NTP, 1992)

CAS Number92-36-4
PubChem CID7087
IUPAC Name4-(6-methyl-1,3-benzothiazol-2-yl)aniline
Molecular FormulaC14H12N2S
Molecular Weight240.33
XLogP3.9
Topological Polar Surface Area67.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity263
SMILES
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N
InChI
InChI=1S/C14H12N2S/c1-9-2-7-12-13(8-9)17-14(16-12)10-3-5-11(15)6-4-10/h2-8H,15H2,1H3
InChIKey
XRTJYEIMLZALBD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-Aminophenyl)-6-methylbenzothiazole
CAS: 92-36-4
CID: 7087
Formula: C14H12N2S
MW: 240.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight240.33
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass240.07211956
Monoisotopic Mass240.07211956
Topological Polar Surface Area67.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity263
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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