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1,1,1,3,3,3-Hexafluoro-2-phenyl-2-propanol - ≥97.0%(GC), high purity , CAS No.718-64-9

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1,1,1,3,3,3-Hexafluoro-2-phenyl-2-propanol - ≥97.0%(GC), high purity , CAS No.718-64-9

COA

Grade & Purity:

≥97%(GC)

Cas Number: 718-64-9
Molecular Weight: 244.14
MDL number: MFCD00040983
PubChem CID: 69748
PubChem SID: 504754436

In stock

Item Number

H135678

Grouped product items
SKU	Size	Availability	Price
H135678-1g	1g	3	$13.90
H135678-5g	5g	5	$52.90
H135678-25g	25g	3	$167.90

View related series

Non heterocyclic fluorine-containing block (1408) Oxygenated compounds (806)

Basic Description

Synonyms	IZPIZCAYJQCTNG-UHFFFAOYSA- \| alpha,alpha-Bis(trifluoromethyl)benzyl alcohol \| InChI=1/C9H6F6O/c10-8(11,12)7(16,9(13,14)15)6-4-2-1-3-5-6/h1-5,16H \| FT-0604631 \| Hexafluoro-2-phenyl-2-propanol \| Benzenemethanol, .alpha.,.alpha.-bis(trifluoromethyl)- \| 1,1,1
Specifications & Purity	≥97%(GC)
Biochemical and Physiological Mechanisms	1,1,1,3,3,3-Hexafluoro-2-phenyl-2-propanol is an effective solvent for Cu(0)-mediated single electron transfer-living radical polymerization of methyl methacrylate and polymerization of styrene.
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzene and substituted derivatives
Alternative Parents	Tertiary alcohols Fluorohydrins Organofluorides Hydrocarbon derivatives Aromatic alcohols Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Monocyclic benzene moiety - Tertiary alcohol - Halohydrin - Fluorohydrin - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Alcohol - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
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

Associated Targets(Human)

PTPN11 Tchem Protein-tyrosine phosphatase 2C (2297 Activities)

Discover Target: PTPN11

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PTPN13 Tchem Protein-tyrosine phosphatase 1E (88 Activities)

Discover Target: PTPN13

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PTPRC Tchem Leukocyte common antigen (2317 Activities)

Discover Target: PTPRC

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

PTPN22 Tchem Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP (1215 Activities)

Discover Target: PTPN22

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)

Discover Target: Ptpn1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504754436
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754436
IUPAC Name	1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-ol
INCHI	InChI=1S/C9H6F6O/c10-8(11,12)7(16,9(13,14)15)6-4-2-1-3-5-6/h1-5,16H
InChIKey	IZPIZCAYJQCTNG-UHFFFAOYSA-N
Smiles	C1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)O
Isomeric SMILES	C1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)O
WGK Germany	3
Molecular Weight	244.14
Reaxy-Rn	2053547
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2053547&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.

10 results found

Lot Number	Certificate Type	Date	Item
H2125227	Certificate of Analysis	Jun 11, 2025	H135678
H2125228	Certificate of Analysis	Jun 11, 2025	H135678
K2208148	Certificate of Analysis	Oct 24, 2022	H135678
G2320079	Certificate of Analysis	Oct 24, 2022	H135678
K2208166	Certificate of Analysis	Oct 24, 2022	H135678
K2209165	Certificate of Analysis	Oct 24, 2022	H135678
I2215272	Certificate of Analysis	Jul 06, 2022	H135678
I2215276	Certificate of Analysis	Jul 06, 2022	H135678
I2215279	Certificate of Analysis	Jul 06, 2022	H135678
G2320063	Certificate of Analysis	Jul 06, 2022	H135678

Chemical and Physical Properties

Refractive Index	1.41
Flash Point(°F)	140 °F
Flash Point(°C)	56°C(lit.)
Boil Point(°C)	159-160°C
Molecular Weight	244.130 g/mol
XLogP3	3.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	1
Exact Mass	244.032 Da
Monoisotopic Mass	244.032 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	223.000
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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