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(2R,3S)-5-Chloro-2-(((4-methylbenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-methylbenzoate - 90%, high purity , CAS No.3601-89-6

1 Citations

COA

Grade & Purity:

≥90%

Cas Number: 3601-89-6
Molecular Weight: 388.84
MDL number: MFCD00079148
PubChem CID: 12907234

In stock

Item Number

R303540

Grouped product items
SKU	Size	Availability	Price
R303540-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
R303540-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$44.90
R303540-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$122.90
R303540-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$224.90

Discover (2R,3S)-5-Chloro-2-(((4-methylbenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-methylbenzoate by Aladdin Scientific in 90% for only $19.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	DS-16976 \| 1-Chloro-2-deoxy-3,5-di-O-toluoyl-D-ribofuranose \| 2-Deoxy-3,5-di-O-p-toluoyl-D-ribofuranosyl Chloride \| AKOS015919626 \| C21H21CLO5 \| 2-Deoxy-3,5-di-o-p-toluoyl-ribofuranosyl chloride \| 2-Deoxy-3,5-di-O-p-toluoyl-D-erythro-pentofuranosyl chlori
Specifications & Purity	≥90%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzoic acid esters
Alternative Parents	Benzoyl derivatives Toluenes Dicarboxylic acids and derivatives Oxolanes Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Benzoate ester - Benzoyl - Toluene - Dicarboxylic acid or derivatives - Oxolane - Carboxylic acid ester - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Ether - Organoheterocyclic compound - Alkyl halide - Hydrocarbon derivative - Alkyl chloride - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
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	[(2R,3S)-5-chloro-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate
INCHI	InChI=1S/C21H21ClO5/c1-13-3-7-15(8-4-13)20(23)25-12-18-17(11-19(22)26-18)27-21(24)16-9-5-14(2)6-10-16/h3-10,17-19H,11-12H2,1-2H3/t17-,18+,19?/m0/s1
InChIKey	FJHSYOMVMMNQJQ-PAMZHZACSA-N
Smiles	CC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)Cl)OC(=O)C3=CC=C(C=C3)C
Isomeric SMILES	CC1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H](CC(O2)Cl)OC(=O)C3=CC=C(C=C3)C
Molecular Weight	388.84
Reaxy-Rn	15521060
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15521060&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Boil Point(°C)	518.4°C at 760 mmHg
Molecular Weight	388.800 g/mol
XLogP3	4.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	388.108 Da
Monoisotopic Mass	388.108 Da
Topological Polar Surface Area	61.800 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	509.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

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