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3,5-Dimethoxybenzamide - 98%, high purity , CAS No.17213-58-0

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3,5-Dimethoxybenzamide - 98%, high purity , CAS No.17213-58-0

COA

Grade & Purity:

≥98%

Cas Number: 17213-58-0
Molecular Weight: 181.19
Beilstein Registry Number: 2641361
EC Number: 241-257-0
MDL number: MFCD00007987
PubChem CID: 72878
PubChem SID: 488184728

In stock

Item Number

D123486

Grouped product items
SKU	Size	Availability	Price
D123486-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
D123486-5g	5g	8	$14.90
D123486-25g	25g	1	$64.90
D123486-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$230.90

View related series

amide (313) Non heterocyclic block (8163)

Basic Description

Synonyms	NSC 16615 \| EINECS 241-257-0 \| 3,5-Dimethoxybenzamide, 97% \| DTXSID20169209 \| MFCD00007987 \| InChI=1/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H2,10,11 \| D1558 \| A852423 \| 3,5-Dimethoxybenzamide \| Oprea1_549641 \| AKOS000278372 \| AM787 \| NSC16
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Methoxybenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Methoxybenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Dimethoxybenzenes
Alternative Parents	Benzamides Phenoxy compounds Benzoyl derivatives Anisoles Alkyl aryl ethers Primary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	M-dimethoxybenzene - Dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy 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

Associated Targets(non-human)

ftsZ Cell division protein ftsZ (97 Activities)

Discover Target: ftsZ

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

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	488184728
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184728
IUPAC Name	3,5-dimethoxybenzamide
INCHI	InChI=1S/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H2,10,11)
InChIKey	YTLRWVNYANKXOW-UHFFFAOYSA-N
Smiles	COC1=CC(=CC(=C1)C(=O)N)OC
Isomeric SMILES	COC1=CC(=CC(=C1)C(=O)N)OC
WGK Germany	3
Molecular Weight	181.19
Beilstein	2641361
Reaxy-Rn	2641361
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2641361&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.

3 results found

Lot Number	Certificate Type	Date	Item
L2410665	Certificate of Analysis	Jun 15, 2024	D123486
K1404058	Certificate of Analysis	Aug 08, 2022	D123486
D2303395	Certificate of Analysis	Aug 08, 2022	D123486

Chemical and Physical Properties

Melt Point(°C)	147 °C
Molecular Weight	181.190 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	181.074 Da
Monoisotopic Mass	181.074 Da
Topological Polar Surface Area	61.600 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	172.000
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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