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2-BUTYLCYCLOHEXANOL (MIXTURE OF ISOMERS) , CAS No.36159-49-6

COA

Cas Number: 36159-49-6
Molecular Weight: 156.27
PubChem CID: 142051

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Item Number

B169910

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SKU	Size	Availability	Price	Qty
B169910-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$100.90

Discover 2-BUTYLCYCLOHEXANOL (MIXTURE OF ISOMERS) by Aladdin Scientific in for only $100.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Butylcyclohexanol \| 2-butylcyclohexan-1-ol \| 36159-49-6 \| Cyclohexanol, 2-butyl-, \| 2-N-butyl-1-cyclohexanol \| NSC75605 \| 2-Butylcyclohexanol # \| Cyclohexanol, 2-butyl- \| NCIOpen2_000735 \| CIS-5-OCTENYLPROPIONATE \| SCHEMBL4640300 \| DTXSID50957570 \| LVDALGYBEFALAP-UHFFFAOYSA-N \|
Storage Temp	Room temperature
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	Cyclic alcohols and derivatives Hydrocarbon derivatives
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Cyclohexanol - Cyclic alcohol - 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	2-butylcyclohexan-1-ol
INCHI	InChI=1S/C10H20O/c1-2-3-6-9-7-4-5-8-10(9)11/h9-11H,2-8H2,1H3
InChIKey	LVDALGYBEFALAP-UHFFFAOYSA-N
Smiles	CCCCC1CCCCC1O
Isomeric SMILES	CCCCC1CCCCC1O
Molecular Weight	156.27
Reaxy-Rn	2071410
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2071410&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	156.260 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	156.151 Da
Monoisotopic Mass	156.151 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	101.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
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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