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3-Chloro-4-methyl-2,6-dinitrophenol - 98%, high purity , CAS No.1330750-45-2

COA

Grade & Purity:

≥98%

Cas Number: 1330750-45-2
Molecular Weight: 232.6
PubChem CID: 54759085

In stock

Item Number

C181208

Grouped product items
SKU	Size	Availability	Price	Qty
C181208-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,106.90
C181208-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,943.90

Discover 3-Chloro-4-methyl-2,6-dinitrophenol by Aladdin Scientific in 98% for only $1,106.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-Chloro-4-methyl-2,6-dinitrophenol \| 1330750-45-2 \| DTXSID30716687 \| MFCD19981505 \| AKOS015907907 \| BS-20904 \| Phenol, 3-chloro-4-methyl-2,6-dinitro- \| CS-0444624
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenols
    - Subclass Nitrophenols

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	Nitrophenols
Intermediate Tree Nodes	Not available
Direct Parent	Dinitrophenols
Alternative Parents	Dinitrotoluenes Nitrobenzenes Para cresols Nitroaromatic compounds M-chlorophenols Chlorobenzenes Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Dinitrotoluene - Dinitrophenol - Nitrobenzene - Nitrotoluene - 3-halophenol - 3-chlorophenol - P-cresol - Nitroaromatic compound - Chlorobenzene - Halobenzene - Toluene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dinitrophenols. These are organic aromatic compounds containing a benzene that carries a single phenol group and exactly two nitro groups.
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	3-chloro-4-methyl-2,6-dinitrophenol
INCHI	InChI=1S/C7H5ClN2O5/c1-3-2-4(9(12)13)7(11)6(5(3)8)10(14)15/h2,11H,1H3
InChIKey	SSFPPEHPQLGLCK-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C(=C1Cl)[N+](=O)[O-])O)[N+](=O)[O-]
Isomeric SMILES	CC1=CC(=C(C(=C1Cl)[N+](=O)[O-])O)[N+](=O)[O-]
PubChem CID	54759085
Molecular Weight	232.6

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	232.580 g/mol
XLogP3	2.800
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	231.989 Da
Monoisotopic Mass	231.989 Da
Topological Polar Surface Area	112.000 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	276.000
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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