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6-Methyl-1,3-benzoxazole - 98%, high purity , CAS No.10531-80-3

COA

Grade & Purity:

≥98%

Cas Number: 10531-80-3
Molecular Weight: 133.1
PubChem CID: 2724969

In stock

Item Number

M179034

Grouped product items
SKU	Size	Availability	Price
M179034-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
M179034-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$178.90
M179034-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$730.90

Discover 6-Methyl-1,3-benzoxazole by Aladdin Scientific in 98% for only $49.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	6-Methylbenzoxazole \| 10531-80-3 \| 6-Methylbenzo[d]oxazole \| 6-methyl-1,3-benzoxazole \| 6-methyl-benzooxazole \| MFCD00216937 \| SCHEMBL354233 \| DTXSID80369304 \| CHEBI:167801 \| SZWNDAUMBWLYOQ-UHFFFAOYSA-N \| AKOS003247527 \| PS-4542 \| RS-1027 \| AM807054 \| SY036502 \| CS-0100362 \| FT-0766287 \|
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzoxazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzoxazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzoxazoles
Alternative Parents	Benzenoids Oxazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzoxazole - Benzenoid - Heteroaromatic compound - Oxazole - Azole - Oxacycle - Azacycle - 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 benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.
External Descriptors	Not available
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

Names and Identifiers

IUPAC Name	6-methyl-1,3-benzoxazole
INCHI	InChI=1S/C8H7NO/c1-6-2-3-7-8(4-6)10-5-9-7/h2-5H,1H3
InChIKey	SZWNDAUMBWLYOQ-UHFFFAOYSA-N
Smiles	CC1=CC2=C(C=C1)N=CO2
Isomeric SMILES	CC1=CC2=C(C=C1)N=CO2
Molecular Weight	133.1
Reaxy-Rn	4849535
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4849535&ln=

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

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	133.150 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	133.053 Da
Monoisotopic Mass	133.053 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	126.000
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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