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Ethyl 10-bromoanthracene-9-carboxylate - ≥97%, high purity , CAS No.1089318-91-1

COA

Grade & Purity:

≥97%

Cas Number: 1089318-91-1
Molecular Weight: 329.2
PubChem CID: 71463822

In stock

Item Number

E734938

Grouped product items
SKU	Size	Availability	Price
E734938-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$35.90
E734938-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$85.90
E734938-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$328.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Anthracenes
    - Subclass Anthracenecarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Anthracenes
Subclass	Anthracenecarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Anthracenecarboxylic acids
Alternative Parents	Naphthalenecarboxylic acids and derivatives 4-halobenzoic acids and derivatives Aryl bromides Carboxylic acid esters Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Anthracene carboxylic acid - 1-naphthalenecarboxylic acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Aryl halide - Aryl bromide - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as anthracenecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an anthracene ring system.
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	ethyl 10-bromoanthracene-9-carboxylate
INCHI	InChI=1S/C17H13BrO2/c1-2-20-17(19)15-11-7-3-5-9-13(11)16(18)14-10-6-4-8-12(14)15/h3-10H,2H2,1H3
InChIKey	CGVWQGPVBMLCSL-UHFFFAOYSA-N
Smiles	CCOC(=O)C1=C2C=CC=CC2=C(C3=CC=CC=C31)Br
Isomeric SMILES	CCOC(=O)C1=C2C=CC=CC2=C(C3=CC=CC=C31)Br
PubChem CID	71463822
Molecular Weight	329.2

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	329.200 g/mol
XLogP3	5.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	328.01 Da
Monoisotopic Mass	328.01 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	333.000
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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