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4,4-dimethoxycyclohexanol - 97%, high purity , CAS No.112906-44-2

COA

Grade & Purity:

≥97%

Cas Number: 112906-44-2
Molecular Weight: 160.21
PubChem CID: 558474

In stock

Item Number

D635450

Grouped product items
SKU	Size	Availability	Price	Qty
D635450-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$541.90

Basic Description

Synonyms	4,4-Dimethoxycyclohexanol \| 112906-44-2 \| 4,4-dimethoxycyclohexan-1-ol \| Cyclohexanol, 4,4-dimethoxy- \| starbld0035300 \| 4,4-Dimethoxycyclohexanol # \| SCHEMBL6677245 \| MFCD22049802 \| PB39624 \| AS-79143 \| D79045
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Alcohols and polyols
      - Level5 Secondary alcohols
        Level6 Cyclohexanols

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Secondary alcohols
Direct Parent	Cyclohexanols
Alternative Parents	Ketals Cyclic alcohols and derivatives Hydrocarbon derivatives
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Ketal - Cyclohexanol - Cyclic alcohol - Acetal - Hydrocarbon derivative - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as cyclohexanols. These are compounds containing an alcohol group attached to a cyclohexane ring.
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	4,4-dimethoxycyclohexan-1-ol
INCHI	InChI=1S/C8H16O3/c1-10-8(11-2)5-3-7(9)4-6-8/h7,9H,3-6H2,1-2H3
InChIKey	RYJHSFHWUXQOPH-UHFFFAOYSA-N
Smiles	COC1(CCC(CC1)O)OC
Isomeric SMILES	COC1(CCC(CC1)O)OC
PubChem CID	558474
Molecular Weight	160.21

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	160.210 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	160.11 Da
Monoisotopic Mass	160.11 Da
Topological Polar Surface Area	38.700 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	111.000
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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