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Decafluorobenzhydrol - 97%, high purity , CAS No.1766-76-3

COA

Grade & Purity:

≥97%

Cas Number: 1766-76-3
Molecular Weight: 364.14
PubChem CID: 74485
PubChem SID: 488184930

In stock

Item Number

D154519

Grouped product items
SKU	Size	Availability	Price
D154519-1g	1g	3	$18.90
D154519-5g	5g	2	$70.90
D154519-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$318.90

Basic Description

Synonyms	Decafluorobenzhydrol \| 1766-76-3 \| Bis(pentafluorophenyl)methanol \| Bis(perfluorophenyl)methanol \| Bis(2,3,4,5,6-pentafluorophenyl)methanol \| 2,3,4,5,6,2',3',4',5',6'-Decafluorobenzhydrol \| Decafluorodiphenylmethanol \| NSC97029 \| EINECS 217-185-0 \| SCHEMBL407601 \| Benzhydrol
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Fluorobenzenes Aryl fluorides Secondary alcohols Organofluorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diphenylmethane - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Organofluoride - Organohalogen compound - Alcohol - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl 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	488184930
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184930
IUPAC Name	bis(2,3,4,5,6-pentafluorophenyl)methanol
INCHI	InChI=1S/C13H2F10O/c14-3-1(4(15)8(19)11(22)7(3)18)13(24)2-5(16)9(20)12(23)10(21)6(2)17/h13,24H
InChIKey	WRLLBTKDSCJOBL-UHFFFAOYSA-N
Smiles	C1(=C(C(=C(C(=C1F)F)F)F)F)C(C2=C(C(=C(C(=C2F)F)F)F)F)O
Isomeric SMILES	C1(=C(C(=C(C(=C1F)F)F)F)F)C(C2=C(C(=C(C(=C2F)F)F)F)F)O
Molecular Weight	364.14
Reaxy-Rn	2067248
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2067248&ln=

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

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

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
K2217930	Certificate of Analysis	Nov 22, 2022	D154519
K2217688	Certificate of Analysis	Nov 22, 2022	D154519
K2217697	Certificate of Analysis	Nov 22, 2022	D154519
K2217678	Certificate of Analysis	Nov 22, 2022	D154519
K2217691	Certificate of Analysis	Nov 22, 2022	D154519
K2217634	Certificate of Analysis	Nov 22, 2022	D154519

Chemical and Physical Properties

Solubility	Insoluble in water.
Boil Point(°C)	110°C/1.5mmHg(lit.)
Melt Point(°C)	77-80°C
Molecular Weight	364.140 g/mol
XLogP3	3.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	2
Exact Mass	363.995 Da
Monoisotopic Mass	363.995 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	371.000
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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