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5-bromo-3-(difluoromethyl)-2-methoxy-pyridine - 97%, high purity , CAS No.1254123-51-7

COA

Grade & Purity:

≥97%

Cas Number: 1254123-51-7
Molecular Weight: 238.03
EC Number: 836-565-2
PubChem CID: 67979709

In stock

Item Number

B627790

Grouped product items
SKU	Size	Availability	Price
B627790-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$349.90
B627790-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,137.90
B627790-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,273.90

Basic Description

Synonyms	AKOS023601008 \| 5-bromo-3-(difluoromethyl)-2-methoxypyridine \| 5-bromo-3-difluoromethyl-2-methoxy-pyridine \| SB85607 \| 1254123-51-7 \| SY045816 \| F12242 \| SCHEMBL9948731 \| A926788 \| MFCD23163928 \| EN300-223737 \| Pyridine, 5-bromo-3-(difluoromethyl)-2-metho
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Ethers

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Ethers
Intermediate Tree Nodes	Not available
Direct Parent	Alkyl aryl ethers
Alternative Parents	Pyridines and derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organobromides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Alkyl aryl ether - Pyridine - Aryl halide - Aryl bromide - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
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	5-bromo-3-(difluoromethyl)-2-methoxypyridine
INCHI	InChI=1S/C7H6BrF2NO/c1-12-7-5(6(9)10)2-4(8)3-11-7/h2-3,6H,1H3
InChIKey	AJNHTTUMXPNNAH-UHFFFAOYSA-N
Smiles	COC1=C(C=C(C=N1)Br)C(F)F
Isomeric SMILES	COC1=C(C=C(C=N1)Br)C(F)F
Alternate CAS	1254123-51-7
PubChem CID	67979709
Molecular Weight	238.03

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	238.030 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	236.96 Da
Monoisotopic Mass	236.96 Da
Topological Polar Surface Area	22.100 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	147.000
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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