5,6-Dimethyl-2-Benzothiazolamine - CAS 29927-08-0

Catalog:	BB020384
Product Name:	5,6-Dimethyl-2-Benzothiazolamine
CAS:	29927-08-0
Synonyms:	5,6-dimethyl-1,3-benzothiazol-2-amine

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	5,6-dimethyl-1,3-benzothiazol-2-amine
Description:	2-Amino-5,6-dimethylbenzothiazole can be used as anti-inflammatory and neuroprotective properties.
Molecular Weight:	178.25
Molecular Formula:	C9H10N2S
Canonical SMILES:	CC1=CC2=C(C=C1C)SC(=N2)N
InChI:	InChI=1S/C9H10N2S/c1-5-3-7-8(4-6(5)2)12-9(10)11-7/h3-4H,1-2H3,(H2,10,11)
InChI Key:	IODWHFFPQHUDAG-UHFFFAOYSA-N
Boiling Point:	342.1 °C at 760 mmHg
Melting Point:	365 to 372 °F
Purity:	98.0%
Density:	1.263 g/cm³
Appearance:	White to pale reddish yellow powder
MDL:	MFCD00005790
LogP:	3.07650

Publication Number	Title	Priority Date
CN-113045993-A	Polishing solution for processing ultra-smooth low-damage bearing steel surface and application thereof	20210325
KR-102178181-B1	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	20200331
KR-20210007121-A	An electroluminescent compound and an electroluminescent device comprising the same	20190710
EP-3901139-A1	Novel hydrazone derivative with aryl or heteroaryl group substituted at terminal amine group thereof and use thereof	20181219
US-2019374577-A1	Expansion of tumor infiltrating lymphocytes with potassium channel agonists and therapeutic uses thereof	20170106

PMID	Publication Date	Title	Journal
15962942	20050601	Prediction of genotoxicity of chemical compounds by statistical learning methods	Chemical research in toxicology

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Related Functional Groups

Benzoxazole/Benzothiazole

[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[180716-28-3]
Benzo[d]oxazol-5-ol
[1488698-24-3]
Benzo[d]oxazol-5-ylmethanol
[1494550-29-6]
Benzo[d]oxazol-6-ylmethanol
[94242-04-3]
Benzo[d]oxazol-7-ol
[1855907-41-3]
6-(2,2,3,3-Tetrafluoropropoxy)-1,3-benzothiazol-2-amine

Oxazole/Thiazole

[852227-91-9]
N-Methyl-5-phenyl-3-isoxazolemethanamine hydrochloride
[1072145-33-5]
ERRα antagonist-1
[885681-46-9]
Ethyl [2-(4-methoxyphenyl)-1,3-thiazol-5-yl]acetate
[19749-93-0]
Ethyl 2-(2-chloroacetamido)-4-thiazoleacetate
[132089-32-8]
Ethyl 2-(4-methylphenyl)-thiazole-4-carboxylate
[1431962-17-2]
Ethyl 2-(cyclopentylamino)-4-methylthiazole-5-carboxylate hydrochloride

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:	174
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.05646950
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	178.05646950
Rotatable Bond Count:	0
Topological Polar Surface Area:	67.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8