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Pentafluorophenol

CAS No.
771-61-9
Chemical Name:
Pentafluorophenol
Synonyms
PFP;2,3,4,5,6-PENTAFLUOROPHENOL;HOPFP;PFP-OH;PENTAFLUORPHENOL;C6F5OH;Pentafluorophe;SSI(R) Unions;PERFLUOROPHENOL;Pentaflurophenol
CBNumber:
CB0135306
Molecular Formula:
C6HF5O
Molecular Weight:
184.06
MDL Number:
MFCD00002156
MOL File:
771-61-9.mol
MSDS File:
SDS
Last updated:2024-01-22 16:43:48

Pentafluorophenol Properties

Melting point 34-36 °C (lit.)
Boiling point 143 °C (lit.)
Density 1.757
refractive index 1.4270
Flash point 162 °F
storage temp. Store below +30°C.
solubility Chloroform (Slightly), Methanol (Slightly)
form Low Melting Crystalline Solid
pka 5.50±0.33(Predicted)
color White to almost white
Specific Gravity 1.757
Water Solubility soluble
BRN 1912584
Stability Stable. Incompatible with strong oxidizing agents, bases, acid chlorides, acid anhydrides.
InChIKey XBNGYFFABRKICK-UHFFFAOYSA-N
CAS DataBase Reference 771-61-9(CAS DataBase Reference)
FDA UNII A2YCF0YUHA
NIST Chemistry Reference Phenol, pentafluoro-(771-61-9)
EPA Substance Registry System Pentafluorophenol (771-61-9)

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H302+H312
Precautionary statements  P264-P270-P280-P301+P312-P302+P352+P312-P362+P364
Hazard Codes  Xi,T,C,Xn
Risk Statements  36/37/38-34-20/21/22-63-43-23/24/25-45-67-40
Safety Statements  26-36-45-36/37/39-36/37-24/25-23-53
RIDADR  2811
WGK Germany  3
RTECS  SM6680000
3
Hazard Note  Toxic/Irritant
TSCA  T
HazardClass  8
PackingGroup  III
HS Code  29081000
Toxicity LD50 scu-rat: 322 mg/kg IZSBAI 3,91,65
NFPA 704
2
3 0

Pentafluorophenol price More Price(58)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 103799 Pentafluorophenol ReagentPlus , ≥99% 771-61-9 5g $42.5 2024-03-01 Buy
Sigma-Aldrich 103799 Pentafluorophenol ReagentPlus , ≥99% 771-61-9 10g $78.3 2024-03-01 Buy
Sigma-Aldrich 8.18100 Pentafluorophenol for synthesis 771-61-9 25g $162 2022-05-15 Buy
TCI Chemical P0919 Pentafluorophenol >98.0%(GC)(T) 771-61-9 10g $50 2024-03-01 Buy
TCI Chemical P0919 Pentafluorophenol >98.0%(GC)(T) 771-61-9 25g $103 2024-03-01 Buy
Product number Packaging Price Buy
103799 5g $42.5 Buy
103799 10g $78.3 Buy
8.18100 25g $162 Buy
P0919 10g $50 Buy
P0919 25g $103 Buy

Pentafluorophenol Chemical Properties,Uses,Production

Description

Pentafluorophenol can be used for the preparation of penta-fluorophenyl esters for peptide synthesis. It is used in the preparation of pentafluorophenyl esters for peptide synthesis and vulcanized polymers. It is also used for peptide coupling and heterocyclic acid derivatives. It is involved in the preparation of pentafluorophenyl formate which acts as a formulating agent for amines and amino acids. It can be used for synthesizing novel reagents which can achieve highly diastereoselective acetal cleavage.

Reference

3. Ishihara, Kazuaki, N. Hanaki, and H. Yamamoto. "Highly diastereoselective acetal cleavages using novel reagents prepared from organoaluminum and pentafluorophenol" Cheminform 25.9(2010):no-no.

Chemical Properties

White solid

Uses

For the preparation of pentafluorophenyl esters for peptide synthesis.

Uses

Used for the preparation of pentafluorophenyl esters for peptide synthesis

Uses

Pentafluorophenol is used in the preparation of pentafluorophenyl esters for peptide synthesis and vulcanized polymers. It is also used for peptide coupling and heterocyclic acid derivatives. It is involved in the preparation of pentafluorophenyl formate which acts as a formulating agent for amines and amino acids.

Synthesis Reference(s)

The Journal of Organic Chemistry, 54, p. 5502, 1989 DOI: 10.1021/jo00284a022

Safety Profile

scu-rat LD50:322 mg/kg IZSBAI 3,91,65

Purification Methods

It is a hygroscopic low melting solid not freely soluble in H2O. Purify it by distillation, preferably in a vacuum [Forbes et al. J Chem Soc 2019 1959, IR and pKa: Birchall & Haszeldine J Chem Soc 13 1959]. IRofafilmhas max 3600 (OH) and 1575 (fluoroaromatic breathing) cm-1 . The benzoyl derivative has m 74-75o, 3,4-dinitrobenzoyl derivative has m 107o, the tosylate has m 64-65o (from EtOH) and the K salt crystallises from Me2CO, m 242o(dec), with 1H2O-salt the m is 248o(dec) and the 2H2O-salt has m 245o(dec). [Beilstein 6 IV 782.]

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View Lastest Price from Pentafluorophenol manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
Pentafluorophenol pictures 2024-01-22 Pentafluorophenol
771-61-9
US $8.00-0.80 / KG 1KG 99% g-kg-tons, free sample is available Henan Fengda Chemical Co., Ltd
Pentafluorophenol pictures 2023-06-26 Pentafluorophenol
771-61-9
US $200.00 / kg 1kg 99% 1000kg/Month Hebei Mingeng Biotechnology Co., Ltd
Pentafluorophenol pictures 2023-06-20 Pentafluorophenol
771-61-9
US $0.00 / KG 1KG 99% 50000KG/month Hebei Mojin Biotechnology Co., Ltd
Pentafluorophenol, 99+% 10GR Pentafluorophenol, 99+% 5GR pentafluorophenol cation PENTAFLUOROPHENOL FOR SYNTHESIS Pentafluorophenol SynonyMs 2,3,4,5,6-Pentafluorophenol Pentafluorophe Pentafluorophenol ReagentPlus(R), >=99% Pentafluorophenol Vetec(TM) reagent grade, 98% PERFLUOROPHENOL PENTAFLUOROPHENOL C6F5OH pentafluoro-pheno phenol,pentafluoro- 2,3,4,5,6-PENTAFLUOROHYDROXYBENZENE Pentafluorophenol≥ 99.5% (GC) PENTAFLUOROPHENOL, 1X1ML, CH2CL2, 2000UG /ML PENTAFLUOROPHENOL, 1000MG,NEAT PENTAFLUOROPHENOL, 99+% Pentaflurophenol 2,3,4,5,6-pentafluorophenol solution pentafluorophenol solution SSI(R) Unions Coupling SSI(R) to Waters Hydroxypentafluorobenzene Pentafluorophenol,2,3,4,5,6-Pentafluorophenol Pentafluorophenol 1g [771-61-9] 2,3,4,5,6-pentafluoropropane phenol Perfluorophenol 99% PFP-OH Pentafluorophenol Pentafluorophenol(PFP-OH) Pentafluorophenol ReagentPlus(R) Sofosbuvir imp-92 Phenol,2,3,4,5,6-pentafluoro- Pentafluorophenol> Pentafluorophenol@0.2 mg/mL in CH2Cl2 Pentafluorophenol,98% Pentafluorophenol ISO 9001:2015 REACH Pentafluorophenol (PFP) extrapure, 99% PFP-OH 2,3,4,5,6-PENTAFLUOROPHENOL HOPFP PENTAFLUORPHENOL PFP Five fluorophenol 771-61-9 C13H10Cl2F5NO2 C6HF5O C6F5KO ALCOHOL Active Esters/Additives Synthetic Reagents Coupling Fluorobenzene Phenol&Thiophenol&Mercaptan Biochemistry Coupling Reactions (Peptide Synthesis) Peptide Synthesis Aromatic Phenols