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2-Methyl(thiobenzamide) - ≥97.0%, high purity , CAS No.53515-19-8

COA

Grade & Purity:

≥97%

Cas Number: 53515-19-8
Molecular Weight: 151.23
MDL number: MFCD03945350
PubChem CID: 816810

In stock

Item Number

M140149

Grouped product items
SKU	Size	Availability	Price
M140149-1g	1g	2	$9.90
M140149-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$15.90
M140149-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90

Discover 2-Methyl(thiobenzamide) by Aladdin Scientific in ≥97.0% for only $9.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	53515-19-8 \| 2-methylbenzothioamide \| 2-Methylbenzenecarbothioamide \| 2-Methylthiobenzamide \| 2-Methyl-thiobenzamide \| 2-methylbenzene-1-carbothioamide \| MFCD03945350 \| thiuram toluene \| methyl-thiobenzamide \| 2-METHYLBENZTHIOAMIDE \| 2-Methylbenzenecarbothioamide # \| SCHEMBL13
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Toluenes
Intermediate Tree Nodes	Not available
Direct Parent	Toluenes
Alternative Parents	Thioamides Thiocarboxylic acid amides Thiocarbonyl compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Toluene - Thioamide - Thiocarboxylic acid amide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Thiocarbonyl group - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane 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	2-methylbenzenecarbothioamide
INCHI	InChI=1S/C8H9NS/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3,(H2,9,10)
InChIKey	DEFUMLHLEJNWIO-UHFFFAOYSA-N
Smiles	CC1=CC=CC=C1C(=S)N
Isomeric SMILES	CC1=CC=CC=C1C(=S)N
Molecular Weight	151.23
Reaxy-Rn	1099684
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1099684&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
D2426203	Certificate of Analysis	Apr 12, 2024	M140149
D2426205	Certificate of Analysis	Apr 12, 2024	M140149
D2426206	Certificate of Analysis	Apr 12, 2024	M140149
D2426204	Certificate of Analysis	Apr 12, 2024	M140149
D2426207	Certificate of Analysis	Apr 12, 2024	M140149

Chemical and Physical Properties

Sensitivity	Air sensitive
Melt Point(°C)	68-73℃
Molecular Weight	151.230 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	151.046 Da
Monoisotopic Mass	151.046 Da
Topological Polar Surface Area	58.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	133.000
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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