ChemicalBook >> CAS DataBase List >>3,3-Difluorocyclobutanecarboxylic acid

3,3-Difluorocyclobutanecarboxylic acid

CAS No.
107496-54-8
Chemical Name:
3,3-Difluorocyclobutanecarboxylic acid
Synonyms
3,3-Difluoro-cyclobutanec...;3-Difluorocyclobutanecarboxylic acid;3,3-Difluorocyclobutanecarboxylic acid;Cyclobutanecarboxylic acid, 3,3-difluoro-;3,3-Difluorocyclobutanecarboxylic acid 98%;3,3-Difluorocyclobutanecarboxylic Acid(WXFC0148);TIANFU-CHEM 107496-54-8 3,3-Difluorocyclobutanecarboxylic acid
CBNumber:
CB8966436
Molecular Formula:
C5H6F2O2
Molecular Weight:
136.1
MDL Number:
MFCD08705857
MOL File:
107496-54-8.mol
MSDS File:
SDS
Last updated:2026-01-13 11:26:14
Product description Number Pack Size Price
3,3-Difluoro-cyclobutanecarboxylic acid Aldrich MNO000127 1g $304
3,3-Difluorocyclobutanecarboxylic Acid >98.0%(GC)(T) D5225 200mg $21
3,3-Difluorocyclobutanecarboxylic Acid >98.0%(GC)(T) D5225 1g $60
3,3-Difluorocyclobutanecarboxylic Acid D447593 250mg $55
3,3-Difluorocyclobutane-1-carboxylic acid FD104436 250mg $250
More product size

3,3-Difluorocyclobutanecarboxylic acid Properties

Melting point 51.0 to 55.0 °C
Boiling point 205 °C
Density 1.37
Flash point 78 °C
storage temp. Keep in dark place,Sealed in dry,Room Temperature
pka 3.63±0.40(Predicted)
form powder to crystal
color White to Light yellow
InChI InChI=1S/C5H6F2O2/c6-5(7)1-3(2-5)4(8)9/h3H,1-2H2,(H,8,9)
InChIKey PLRCVBKYFLWAAT-UHFFFAOYSA-N
SMILES C1(C(O)=O)CC(F)(F)C1
UNSPSC Code 12352106
NACRES NA.21

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H302+H312-H315-H319-H335
Precautionary statements  P261-P264-P280-P301+P312-P302+P352+P312-P305+P351+P338
target organs Respiratory system
RIDADR  UN 3261 8/PG III
WGK Germany  3
HazardClass  IRRITANT
PackingGroup  III
HS Code  2916200090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704
0
3 0

3,3-Difluorocyclobutanecarboxylic acid price More Price(23)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich MNO000127 3,3-Difluoro-cyclobutanecarboxylic acid Aldrich 107496-54-8 1g $304 2026-03-19 Buy
TCI Chemical D5225 3,3-Difluorocyclobutanecarboxylic Acid >98.0%(GC)(T) 107496-54-8 200mg $21 2026-03-19 Buy
TCI Chemical D5225 3,3-Difluorocyclobutanecarboxylic Acid >98.0%(GC)(T) 107496-54-8 1g $60 2026-03-19 Buy
TRC D447593 3,3-Difluorocyclobutanecarboxylic Acid 107496-54-8 250mg $55 2021-12-16 Buy
Biosynth Carbosynth FD104436 3,3-Difluorocyclobutane-1-carboxylic acid 107496-54-8 250mg $250 2021-12-16 Buy
Product number Packaging Price Buy
MNO000127 1g $304 Buy
D5225 200mg $21 Buy
D5225 1g $60 Buy
D447593 250mg $55 Buy
FD104436 250mg $250 Buy

3,3-Difluorocyclobutanecarboxylic acid Chemical Properties,Uses,Production

Uses

3,3-Difluorocyclobutane carboxylic acid is used as an organic and pharmaceutical intermediate.

Synthesis Reference(s)

Synthetic Communications, 35, p. 657, 2005 DOI: 10.1081/SCC-200050350

Synthesis

benzyl 3,3-difluorocyclobutanecarboxylate

935273-86-2

3,3-Difluorocyclobutanecarboxylic acid

107496-54-8

General procedure for the synthesis of 3,3-difluorocyclobutanecarboxylic acid from benzyl ester of 3,3-difluorocyclobutanecarboxylate: benzyl ester of 3,3-difluorocyclobutanecarboxylic acid (0.84 g, 3.72 mmol) was dissolved in ethanol (40 mL), and about 0.02 g of palladium/activated carbon catalyst was added. The reaction mixture was stirred at room temperature for 12 hours in a hydrogen atmosphere. Upon completion of the reaction, the catalyst was removed by filtration through a diatomaceous earth pad. The filtrate was concentrated and dried under vacuum to afford the target product 3,3-difluorocyclobutanecarboxylic acid (0.46 g, 90% yield). The structure of the product was confirmed by 1H NMR (400 MHz, CDCl3): δ 3.16-2.55 (m, 5H).

References

[1] Patent: WO2013/107405, 2013, A1. Location in patent: Page/Page column 42
[2] Patent: US2015/87600, 2015, A1. Location in patent: Page/Page column
[3] Patent: EP3290418, 2018, A1. Location in patent: Paragraph 0172; 0181
[4] Patent: US9273058, 2016, B2. Location in patent: Page/Page column 337; 338
[5] Patent: WO2007/47625, 2007, A2. Location in patent: Page/Page column 24

681128-38-1
107496-54-8
Synthesis of 3,3-Difluorocyclobutanecarboxylic acid from Cyclobutanecarboxylic acid, 3,3-difluoro-, ethyl ester (9CI)
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Alchem Pharmtech,Inc.
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CONIER CHEM AND PHARMA LIMITED
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View Lastest Price from 3,3-Difluorocyclobutanecarboxylic acid manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
3,3-Difluorocyclobutanecarboxylic acid pictures 2025-04-04 3,3-Difluorocyclobutanecarboxylic acid
107496-54-8
US $0.00-0.00 / kg 1kg 98% 1Ton Henan Aochuang Chemical Co.,Ltd.
3,3-Difluorocyclobutanecarboxylic acid pictures 2024-02-26 3,3-Difluorocyclobutanecarboxylic acid
107496-54-8
US $0.00-0.00 / kg 1kg 98% Kgs BTC Nantong Pharmaceuticals Technology Co.,Ltd
3,3-Difluorocyclobutanecarboxylic acid pictures 2021-07-02 3,3-Difluorocyclobutanecarboxylic acid
107496-54-8
US $15.00-10.00 / KG 1KG 99%+ HPLC Monthly supply of 1 ton Zhuozhou Wenxi import and Export Co., Ltd

3,3-Difluorocyclobutanecarboxylic acid Spectrum

3,3-Difluoro-cyclobutanec... Cyclobutanecarboxylic acid, 3,3-difluoro- 3,3-Difluorocyclobutanecarboxylic acid 3,3-Difluorocyclobutanecarboxylic Acid(WXFC0148) 3,3-Difluorocyclobutanecarboxylic acid 98% 3-Difluorocyclobutanecarboxylic acid TIANFU-CHEM 107496-54-8 3,3-Difluorocyclobutanecarboxylic acid 107496-54-8