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Methyl (1R,3S)-3-(Hydroxymethyl)Cyclopentanecarboxylate - 97%, high purity , CAS No.58240-93-0

COA

Grade & Purity:

≥97%

Cas Number: 58240-93-0
Molecular Weight: 158.197
PubChem CID: 13425819
PubChem SID: 488198432

In stock

Item Number

R176854

Grouped product items
SKU	Size	Availability	Price
R176854-50mg	50mg	3	$60.90
R176854-250mg	250mg	2	$253.90
R176854-1g	1g	2	$683.90

Discover Methyl (1R,3S)-3-(Hydroxymethyl)Cyclopentanecarboxylate by Aladdin Scientific in 97% for only $60.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	58240-93-0 \| METHYL CIS-3-HYDROXYMETHYLCYCLOPENTANE-1-CARBOXYLATE \| rel-methyl (1R,3S)-3-(hydroxymethyl)cyclopentane-1-carboxylate \| MFCD06799098 \| METHYL (1R,3S)-3-(HYDROXYMETHYL)CYCLOPENTANE-1-CARBOXYLATE \| SCHEMBL1660231 \| METHYLCIS-3-HYDROXYMETHYLCYCLOPENTANE-1-C
Specifications & Purity	≥97%
Storage Temp	Room temperature,Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Carboxylic acid derivatives
      - Level5 Carboxylic acid esters
        Level6 Methyl esters

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Carboxylic acid derivatives
Intermediate Tree Nodes	Carboxylic acid esters
Direct Parent	Methyl esters
Alternative Parents	Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Methyl ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as methyl esters. These are organic compounds containing a carboxyl group that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=H or organyl group and R'=methyl 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

Pubchem Sid	488198432
IUPAC Name	methyl (1R,3S)-3-(hydroxymethyl)cyclopentane-1-carboxylate
INCHI	InChI=1S/C8H14O3/c1-11-8(10)7-3-2-6(4-7)5-9/h6-7,9H,2-5H2,1H3/t6-,7+/m0/s1
InChIKey	QFZTZFHLMOJRBN-NKWVEPMBSA-N
Smiles	COC(=O)C1CCC(C1)CO
Isomeric SMILES	COC(=O)[C@@H]1CC[C@@H](C1)CO
PubChem CID	13425819
Molecular Weight	158.197

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.

4 results found

Lot Number	Certificate Type	Date	Item
K2212591	Certificate of Analysis	Jun 21, 2022	R176854
K2212576	Certificate of Analysis	Jun 21, 2022	R176854
C2528243	Certificate of Analysis	Jun 21, 2022	R176854
K2212494	Certificate of Analysis	Jun 21, 2022	R176854

Chemical and Physical Properties

Molecular Weight	158.190 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	158.094 Da
Monoisotopic Mass	158.094 Da
Topological Polar Surface Area	46.500 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	144.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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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