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Anthranil - >98.0%(GC), high purity , CAS No.271-58-9

COA

Grade & Purity:

≥98%(GC)

Cas Number: 271-58-9
Molecular Weight: 119.12
Beilstein Registry Number: 27(4)1068
MDL number: MFCD00005806
PubChem CID: 67498
PubChem SID: 504754163

In stock

Item Number

A151655

Grouped product items
SKU	Size	Availability	Price
A151655-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$22.90
A151655-1g	1g	3	$71.90
A151655-5g	5g	3	$274.90

View related series

Five-Membered Heterocyclic Compounds (2064) Oxazoles (110)

Basic Description

Synonyms	SCHEMBL175342 \| AKOS005255306 \| InChI=1/C7H5NO/c1-2-4-7-6(3-1)5-9-8-7/h1-5 \| NCIOpen2_002087 \| T70698 \| EINECS 205-980-5 \| DTXSID00181565 \| SY051668 \| 2,1-benzoxazole \| NSC99331 \| NSC-99331 \| UNII-58GQ20G9W6 \| Benz(c)isoxazole \| Anthranil, 99% \| 2,1-Benzi
Specifications & Purity	≥98%(GC)
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Not available
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzenoids
Alternative Parents	Isoxazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzenoid - Heteroaromatic compound - Isoxazole - Azole - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzenoids. These are aromatic compounds containing one or more benzene rings.
External Descriptors	mancude organic heterobicyclic parent - 2,1-benzoxazoles
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504754163
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754163
IUPAC Name	2,1-benzoxazole
INCHI	InChI=1S/C7H5NO/c1-2-4-7-6(3-1)5-9-8-7/h1-5H
InChIKey	FZKCAHQKNJXICB-UHFFFAOYSA-N
Smiles	C1=CC2=CON=C2C=C1
Isomeric SMILES	C1=CC2=CON=C2C=C1
WGK Germany	3
Molecular Weight	119.12
Beilstein	27(4)1068
Reaxy-Rn	2222
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2222&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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.

8 results found

Lot Number	Certificate Type	Date	Item
H2204346	Certificate of Analysis	May 12, 2025	A151655
H2204345	Certificate of Analysis	May 12, 2025	A151655
K2422213	Certificate of Analysis	Jun 18, 2024	A151655
F2103044	Certificate of Analysis	Mar 12, 2024	A151655
D2328135	Certificate of Analysis	Dec 24, 2022	A151655
D2328126	Certificate of Analysis	Dec 24, 2022	A151655
D2328131	Certificate of Analysis	Dec 24, 2022	A151655
E2320336	Certificate of Analysis	Jul 23, 2022	A151655

Chemical and Physical Properties

Sensitivity	air sensitive
Refractive Index	1.58
Flash Point(°F)	201.2 °F
Flash Point(°C)	94°C(lit.)
Boil Point(°C)	101°C/15mmHg(lit.)
Molecular Weight	119.120 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	119.037 Da
Monoisotopic Mass	119.037 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	105.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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