Benzotiazol - ≥96% , CAS No.95-16-9

CAS: 95-16-9 Cat. No.: B104854 Peso molecular: 135.19 Beilstein Registry Number: 109468 Número EC: 202-396-2
Disponible para pedir
GRADE & PURITY ≥96%
Synonyms
AKOS000120178 | NCGC00257070-01 | Benzotiazol, Vetec(TM) grado reactivo, 96% | D77749 | EC 202-396-2 | FT-0662581 | Benzotiazol, estándar analítico | CCRIS 7893 | SCHEMBL9304593 | FEMA No. 3256 | HSDB 2796 | AI3-05742 | Benzosulfonazol | NCGC00091399
Storage
Argon charged,Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
25g
B104854-25g
4
11,90US$
100g
B104854-100g
4
19,90US$
500g
B104854-500g
1
203,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 62 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
AKOS000120178 | NCGC00257070-01 | Benzotiazol, Vetec(TM) grado reactivo, 96% | D77749 | EC 202-396-2 | FT-0662581 | Benzotiazol, estándar analítico | CCRIS 7893 | SCHEMBL9304593 | FEMA No. 3256 | HSDB 2796 | AI3-05742 | Benzosulfonazol | NCGC00091399
Especificaciones y pureza
≥96%
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Enviado en
Normal
Pureza
≥96%
Nombres e identificadores
Pubchem Sid504751273
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504751273
Sonrisas canónicasC1=CC=C2C(=C1)N=CS2
IUPAC Name1,3-benzothiazole
InChIKeyIOJUPLGTWVMSFF-UHFFFAOYSA-N
INCHI1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H
Isómeros SMILES C1=CC=C2C(=C1)N=CS2
WGK Alemania 2
RTECS DL0875000
Número ONU 2810
Peso molecular 135.19
Beilstein 109468
Reaxy-Rn 109468
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109468&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseBenzothiazoles
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzothiazoles
Alternative Parents Benzenoids  Thiazoles  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 1,3-benzothiazole - Benzenoid - Heteroaromatic compound - Thiazole - Azole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors benzothiazoles
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
PRKAA2 Tchem AMP-activated protein kinase, alpha-2 subunit (1328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCT-116 (91556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NCI-H522 (44358 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
IDO1 Tchem Indoleamine 2,3-dioxygenase (6650 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GMNN Tbio Geminin (128009 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot NumberCertificate TypeFechaArticulo
I2215093Certificate of AnalysisJun 15, 2026 B104854
I2203040Certificate of AnalysisJun 11, 2026 B104854
I2203041Certificate of AnalysisJun 11, 2026 B104854
G2107322Certificate of AnalysisApr 03, 2025 B104854
B2311439Certificate of AnalysisFeb 18, 2023 B104854
B2311440Certificate of AnalysisFeb 17, 2023 B104854
L2214706Certificate of AnalysisDec 23, 2022 B104854
I2215092Certificate of AnalysisSep 22, 2022 B104854
I2203039Certificate of AnalysisSep 09, 2022 B104854
H1808015Certificate of AnalysisJun 16, 2022 B104854
Propiedades químicas y físicas
SolubilidadSlightly soluble in water. Soluble in alcohol, carbon disulfide
SensibilidadLight & air sensitive.
Índice de refracción1.6379
Punto de inflamación (°F)224.6 °F
Punto de inflamación (°C)107 °C
Punto de ebullición (°C)231°C
Punto de fusión (°C)2°C
Peso molecular135.190 g/mol
XLogP32.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass135.014 Da
Monoisotopic Mass135.014 Da
Topological Polar Surface Area41.100 Ų
Heavy Atom Count9
Formal Charge0
Complexity105.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Preguntas frecuentes y artículos
Citations of This Product
Referencias
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18. Yue Wei, Gang Li, Yanhui Yi, Jiaxu Liu, Hongchen Guo.  (2020)  An octane mediated strategy towards Ti-containing HMS-type mesoporous materials incorporated with methyl for high-efficiency oxidative desulfurization.  FUEL,      [PMID:] [10.1016/j.fuel.2020.118660]
19. Shuang Zhu, Hanlin Cheng, Yafen Dai, Jiajun Gao, Xingmao Jiang.  (2020)  Extractive Desulfurization and Denitrogenation from Fuel Oil by a Polyether-Amine-Based Solvent.  ENERGY & FUELS,      [PMID:] [10.1021/acs.energyfuels.0c01096]
20. Xingye Zeng, Xinyan Xiao, Jiayi Chen, Yi Wang, Hanlu Wang.  (2020)  Understanding the effects of co-exposed facets on photocatalytic activities and fuel desulfurization performance in BiOCl singlet-crystalline sheets.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:32036310] [10.1016/j.jhazmat.2020.122198]
21. Bao Wang, Bin Dai, Mingyuan Zhu.  (2019)  Application of Fumed Silica as a Support during Oxidative Desulfurization.  ACS Omega,      [PMID:31956785] [10.1021/acsomega.9b02802]
22. Mengxiang Gan, Guoqing Yang, Zhihan Wang, Xiaofeng Sui, Yu Hou.  (2019)  Highly Efficient Oxidative Desulfurization Catalyzed by a Polyoxometalate/Carbonized Cellulose Nanofiber Composite.  ENERGY & FUELS,      [PMID:] [10.1021/acs.energyfuels.9b03712]
23. Li Zheng, Jun-jian Situ, Qing-feng Zhu, Ping-gen Xi, Yin Zheng, Hong-xia Liu, Xiaofan Zhou, Zi-de Jiang.  (2019)  Identification of volatile organic compounds for the biocontrol of postharvest litchi fruit pathogen Peronophythora litchii.  POSTHARVEST BIOLOGY AND TECHNOLOGY,      [PMID:] [10.1016/j.postharvbio.2019.05.009]
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