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2-Aminobenzothiazole

CAT: 0804-HY-W017424-01Size: 50 gDry Ice: NoHazardous: No
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CAT#:0804-HY-W017424-01Size:50 g
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Description
2-Aminobenzothiazole is a favorable ligand to synthesize dinuclear complexes which contain nitrogen heterocycle. 2-Aminobenzothiazole is a neutral ionophore used for construction of a PVC-based membrane selective electrode for determination of Ce3+ ions. 2-Aminobenzothiazole can produce a new sorbent when bonds chemically to multiwalled carbon nanotubes[1][2][3].
CAS Number
136-95-8
UNSPSC
12352005
Hazard Statement
H302, H319
Target
Drug Intermediate
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/benzo-d-thiazol-2-amine.html
Purity
99.74
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
NC1=NC2=CC=CC=C2S1
Molecular Formula
C7H6N2S
Molecular Weight
150.21
Precautions
H302, H319
References & Citations
[1]Gao E, et al. Synthesis, characterization, interaction with DNA, and cytotoxic effect in vitro of new mono- and dinuclear Pd (II) and Pt (II) complexes with benzo[d]thiazol-2-amine as the primary ligand. Inorg Chem. 2011 Jun 6;50 (11) :4732-41.|[2]Akhond M., (2004) A new cerium (III) -selective membrane electrode based on 2-aminobenzothiazole. Sensors and Actuators B: Chemical, 99 (2-3), 410-415. |[3]Li, R., et al. Multiwalled carbon nanotubes modified with 2-aminobenzothiazole modified for uniquely selective solid-phase extraction and determination of Pb (II) ion in water samples. Microchim Acta 172, 269–276 (2011) .
Shipping Conditions
Room Temperature
Storage Conditions
RT, protect from light
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Benzo(d)thiazol-2-amine

2-aminobenzothiazole is a member of benzothiazoles.

CAS Number136-95-8
PubChem CID8706
IUPAC Name1,3-benzothiazol-2-amine
Molecular FormulaC7H6N2S
Molecular Weight150.20
XLogP1.9
Topological Polar Surface Area67.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity129
SMILES
C1=CC=C2C(=C1)N=C(S2)N
InChI
InChI=1S/C7H6N2S/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H2,8,9)
InChIKey
UHGULLIUJBCTEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzo(d)thiazol-2-amine
CAS: 136-95-8
CID: 8706
Formula: C7H6N2S
MW: 150.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight150.20
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass150.02516937
Monoisotopic Mass150.02516937
Topological Polar Surface Area67.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity129
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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