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1H,1H,11H,11H-Perfluoro-3,6,9-trioxaundecane-1,11-diol - 98%, high purity , CAS No.330562-44-2

COA

Grade & Purity:

≥98%

Cas Number: 330562-44-2
Molecular Weight: 410.11
PubChem CID: 2778166
PubChem SID: 504761999

In stock

Item Number

H331555

Grouped product items
SKU	Size	Availability	Price
H331555-1g	1g	3	$65.90
H331555-5g	5g	1	$229.90
H331555-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$799.90

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Fatty chain compounds (194)

Basic Description

Synonyms	A821590 \| 2-[2-[2-[1,1-bis(fluoranyl)-2-oxidanyl-ethoxy]-1,1,2,2-tetrakis(fluoranyl)ethoxy]-1,1,2,2-tetrakis(fluoranyl)ethoxy]-2,2-bis(fluoranyl)ethanol \| 2-[2-[2-(1,1-difluoro-2-hydroxyethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-2,2-dif
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Halohydrins
    - Subclass Fluorohydrins

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Halohydrins
Subclass	Fluorohydrins
Intermediate Tree Nodes	Not available
Direct Parent	Fluorohydrins
Alternative Parents	Primary alcohols Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Fluorohydrin - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organofluoride - Alkyl halide - Alkyl fluoride - Alcohol - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as fluorohydrins. These are alcohols substituted by a fluorine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups.
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	504761999
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761999
IUPAC Name	2-[2-[2-(1,1-difluoro-2-hydroxyethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-2,2-difluoroethanol
INCHI	InChI=1S/C8H6F12O5/c9-3(10,1-21)23-5(13,14)7(17,18)25-8(19,20)6(15,16)24-4(11,12)2-22/h21-22H,1-2H2
InChIKey	BFMDZOWJRVLYPB-UHFFFAOYSA-N
Smiles	C(C(OC(C(OC(C(OC(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Isomeric SMILES	C(C(OC(C(OC(C(OC(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Molecular Weight	410.11
Reaxy-Rn	11238340
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11238340&ln=

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

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

Analytical Chart:

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8 results found

Lot Number	Certificate Type	Date	Item
F2517309	Certificate of Analysis	Aug 16, 2024	H331555
H2429426	Certificate of Analysis	Aug 16, 2024	H331555
H2429427	Certificate of Analysis	Aug 16, 2024	H331555
H2429428	Certificate of Analysis	Aug 16, 2024	H331555
H2429429	Certificate of Analysis	Aug 16, 2024	H331555
K2204564	Certificate of Analysis	Aug 30, 2022	H331555
K2204571	Certificate of Analysis	Aug 30, 2022	H331555
K2204568	Certificate of Analysis	Aug 30, 2022	H331555

Chemical and Physical Properties

Boil Point(°C)	88° C at 0.2 mmHg
Melt Point(°C)	40-42° C
Molecular Weight	410.110 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	17
Rotatable Bond Count	10
Exact Mass	410.002 Da
Monoisotopic Mass	410.002 Da
Topological Polar Surface Area	68.200 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	413.000
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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