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1,2-Cyclododecanediol (cis- and trans- mixture) - 95%, high purity , CAS No.15199-41-4

COA

Grade & Purity:

≥95%

Cas Number: 15199-41-4
Molecular Weight: 200.32
Beilstein Registry Number: 6(4)5265
MDL number: MFCD01321150
PubChem CID: 85817
PubChem SID: 504755830

In stock

Item Number

C153238

Grouped product items
SKU	Size	Availability	Price	Qty
C153238-250mg	250mg	2	$47.90
C153238-1g	1g	2	$147.90

View related series

alcohol (850) Non heterocyclic block (8163)

Basic Description

Synonyms	EINECS 239-256-5 \| DTXSID00934391 \| HAMFVYJFVXTJCJ-UHFFFAOYSA- \| InChI=1/C12H24O2/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h11-14H,1-10H2 \| SCHEMBL560334 \| MFCD01321150 \| T70323 \| AKOS024332884 \| 1,2-Cyclododecanediol(cis+ trans) \| 1,2-Cyclododecanediol \| Cyc
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Alcohols and polyols
      - Level5 Polyols
        Level6 1,2-diols

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Polyols
Direct Parent	1,2-diols
Alternative Parents	Secondary alcohols Hydrocarbon derivatives
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Secondary alcohol - 1,2-diol - Hydrocarbon derivative - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as 1,2-diols. These are polyols containing an alcohol group at two adjacent positions.
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	504755830
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504755830
IUPAC Name	cyclododecane-1,2-diol
INCHI	InChI=1S/C12H24O2/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h11-14H,1-10H2
InChIKey	HAMFVYJFVXTJCJ-UHFFFAOYSA-N
Smiles	C1CCCCCC(C(CCCC1)O)O
Isomeric SMILES	C1CCCCCC(C(CCCC1)O)O
Molecular Weight	200.32
Beilstein	6(4)5265
Reaxy-Rn	2324042
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2324042&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.

2 results found

Lot Number	Certificate Type	Date	Item
K2321077	Certificate of Analysis	Oct 13, 2023	C153238
K2321078	Certificate of Analysis	Oct 13, 2023	C153238

Chemical and Physical Properties

Molecular Weight	200.320 g/mol
XLogP3	3.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	200.178 Da
Monoisotopic Mass	200.178 Da
Topological Polar Surface Area	40.500 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	120.000
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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