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4-methoxycyclohexanecarboxylic acid - ≥97%,mixture of cis and trans, high purity , CAS No.95233-12-8

COA

Grade & Purity:

≥97%,mixture of cis and trans

Cas Number: 95233-12-8
Molecular Weight: 158.19
EC Number: 628-803-7
MDL number: MFCD00074992
PubChem CID: 736153
PubChem SID: 504760042

In stock

Item Number

M635313

Grouped product items
SKU	Size	Availability	Price
M635313-100mg	100mg	3	$19.90
M635313-250mg	250mg	3	$38.90
M635313-1g	1g	3	$124.90

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Acids (103)

Basic Description

Synonyms	EN300-6770515 \| 4-METHOXYCYCLOHEXANECARBOXYLIC ACID \| FT-0731100 \| SB15662 \| Trans-4-methoxycyclohexane carboxylic acid \| WKILSRYNRQGRMA-KNVOCYPGSA-N \| SCHEMBL1979948 \| AKOS027336855 \| SCHEMBL2444574 \| 4-methoxycylcohexanecarboxylic acid \| Cyclohexanecarb
Specifications & Purity	≥97%,mixture of cis and trans
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Carboxylic acids

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Carboxylic acids
Intermediate Tree Nodes	Not available
Direct Parent	Carboxylic acids
Alternative Parents	Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
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	504760042
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504760042
IUPAC Name	4-methoxycyclohexane-1-carboxylic acid
INCHI	InChI=1S/C8H14O3/c1-11-7-4-2-6(3-5-7)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
InChIKey	WKILSRYNRQGRMA-UHFFFAOYSA-N
Smiles	COC1CCC(CC1)C(=O)O
Isomeric SMILES	COC1CCC(CC1)C(=O)O
Alternate CAS	73873-61-7
Molecular Weight	158.19
Reaxy-Rn	3239139
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3239139&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.

6 results found

Lot Number	Certificate Type	Date	Item
F2411353	Certificate of Analysis	May 30, 2024	M635313
F2411355	Certificate of Analysis	May 30, 2024	M635313
F2411357	Certificate of Analysis	May 30, 2024	M635313
F2411358	Certificate of Analysis	May 30, 2024	M635313
F2411359	Certificate of Analysis	May 30, 2024	M635313
F2411354	Certificate of Analysis	May 30, 2024	M635313

Chemical and Physical Properties

Molecular Weight	158.190 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
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	136.000
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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