Hexafluoroacetone

Modify Date: 2026-07-13 18:40:59

Hexafluoroacetone structure	Common Name	Hexafluoroacetone
	CAS Number	684-16-2	Molecular Weight	166.022
	Density	1.5±0.1 g/cm3	Boiling Point	-28.0±0.0 °C at 760 mmHg
	Molecular Formula	C₃F₆O	Melting Point	−129 °C(lit.)
	MSDS	N/A	Flash Point	-23.6±20.1 °C

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name	hexafluoroacetone
Synonym	More Synonyms

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density	1.5±0.1 g/cm3
Boiling Point	-28.0±0.0 °C at 760 mmHg
Melting Point	−129 °C(lit.)
Molecular Formula	C₃F₆O
Molecular Weight	166.022
Flash Point	-23.6±20.1 °C
Exact Mass	165.985336
PSA	17.07000
LogP	1.89
Vapour density	1.65 (vs air)
Vapour Pressure	5006.3±0.1 mmHg at 25°C
Index of Refraction	1.248
InChIKey	VBZWSGALLODQNC-UHFFFAOYSA-N
SMILES	O=C(C(F)(F)F)C(F)(F)F

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

Hexafluoroacetone MSDS(Chinese)

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UC2450000

CHEMICAL NAME :: 2-Propanone, 1,1,1,3,3,3-hexafluoro-

CAS REGISTRY NUMBER :: 684-16-2

LAST UPDATED :: 199712

DATA ITEMS CITED :: 20

MOLECULAR FORMULA :: C3-F6-O

MOLECULAR WEIGHT :: 166.03

WISWESSER LINE NOTATION :: FXFFVXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 191 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 6,341,1964

TYPE OF TEST :: LC50 - Lethal concentration, 50 percent kill

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 275 ppm/3H

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 6,341,1964 ** REPRODUCTIVE DATA **

TYPE OF TEST :: TCLo - Lowest published toxic concentration

ROUTE OF EXPOSURE :: Inhalation

DOSE :: 12 ppm/6H

SEX/DURATION :: male 30 day(s) pre-mating

TOXIC EFFECTS :: Reproductive - Paternal Effects - spermatogenesis (incl. genetic material, sperm morphology, motility, and count) Reproductive - Paternal Effects - testes, epididymis, sperm duct

REFERENCE :: TXCYAC Toxicology. (Elsevier Scientific Pub. Ireland, Ltd., POB 85, Limerick, Ireland) V.1- 1973- Volume(issue)/page/year: 67,249,1991

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Administration onto the skin

DOSE :: 100 mg/kg

SEX/DURATION :: female 6-15 day(s) after conception

TOXIC EFFECTS :: Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)

REFERENCE :: FAATDF Fundamental and Applied Toxicology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1981- Volume(issue)/page/year: 2,73,1982

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Administration onto the skin

DOSE :: 55 mg/kg

SEX/DURATION :: female 6-16 day(s) after conception

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 41,195,1977 *** REVIEWS *** ACGIH TLV-TWA 0.68 mg/m3 (0.1 ppm) (skin) DTLVS* The Threshold Limit Values (TLVs) and Biological Exposure Indices (BEIs) booklet issues by American Conference of Governmental Industrial Hygienists (ACGIH), Cincinnati, OH, 1996 Volume(issue)/page/year: TLV/BEI,1997 *** U.S. STANDARDS AND REGULATIONS *** MSHA STANDARD-air:TWA 0.1 ppm (0.7 mg/m3) DTLWS* "Documentation of the Threshold Limit Values for Substances in Workroom Air," Supplements. For publisher information, see 85INA8. Volume(issue)/page/year: 3,20,1973 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-AUSTRALIA:TWA 0.1 ppm (0.7 mg/m3);Skin JAN 1993 OEL-BELGIUM:TWA 0.1 ppm (0.68 mg/m3);Skin JAN 1993 OEL-DENMARK:TWA 0.1 ppm (0.7 mg/m3) JAN 1993 OEL-FINLAND:TWA 0.1 ppm (0.7 mg/m3);STEL 0.3 ppm (2.1 mg/m3) JAN 1993 OEL-FRANCE:TWA 0.1 ppm (0.7 mg/m3) JAN 1993 OEL-THE NETHERLANDS:TWA 0.1 ppm (0.7 mg/m3) JAN 1993 OEL-SWITZERLAND:TWA 0.1 ppm (0.7 mg/m3);Skin JAN 1993 OEL IN BULGARIA, COLOMBIA, JORDAN, KOREA check ACGIH TLV OEL IN NEW ZEALAND, SINGAPORE, VIETNAM check ACGIH TLV *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH RECOMMENDED EXPOSURE LEVEL (REL) : NIOSH REL TO HEXAFLUOROACETONE-air:10H TWA 0.1 ppm (Sk) REFERENCE : NIOSH* National Institute for Occupational Safety and Health, U.S. Dept. of Health, Education, and Welfare, Reports and Memoranda. Volume(issue)/page/year: DHHS #92-100,1992 NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83899 No. of Facilities: 14 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 141 (estimated)

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Hazard Codes	T:Toxic;
Risk Phrases	R60;R14;R23/24/25;R34;R63
Safety Phrases	S53-S26-S28-S36-S45-S7/9
RIDADR	UN 2420 2.3
WGK Germany	3
RTECS	UC2450000
Hazard Class	2.3
HS Code	2914700090

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor 10
CAS#:791-50-4 2,2,4,4-Tetra(t... CAS#:428-59-1 Hexafluoropropy... CAS#:431-35-6 1-Bromo-3,3,3-t... CAS#:383-63-1 Ethyl trifluoro...
CAS#:134638-72-5 1-(3-Bromopheny... CAS#:51689-98-6 1,1,3,3,3-penta... CAS#:161117-83-5 tert-butyl 2-me... CAS#:382-10-5 Hexafluoroisobutene
CAS#:116-15-4 Hexafluoropropylene CAS#:67-64-1 Acetone
DownStream 10
CAS#:10487-11-3 4-Heptanone,1,1... CAS#:66711-86-2 trans-1,1,1,4,4... CAS#:407-59-0 1,1,1,4,4,4-hex... CAS#:367-53-3 1,1,1,4,4,4-hex...
CAS#:71040-05-6 1,1,1,6,6,6-hex... CAS#:85720-81-6 2-(1,2-dichloro... CAS#:76-14-2 1,2-dichlorotet... CAS#:375-45-1 butane, 1,2,3,4...
CAS#:57069-95-1 1,1,1,3,3-penta... CAS#:31898-68-7 2,2-BIS(TRIFLUO...

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code	2914700090
Summary	HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

Perfluoroacetone

1,1,1,3,3,3-hexafluoro-2-propanone

1,1,1,3,3,3-Hexafluoroacetone

GC 7887

1,1,1,3,3,3-hexafluoropropan-2-one

2-Propanone,1,1,1,3,3,3-hexafluoro

EINECS 211-676-3

tri-fluoromethyl ketone

Hexafluoroacetone

Perfluoro-2-propanone

MFCD00000422

Hexafluoro-2-propanone

Acetone,hexafluoro

1,1,1,3,3,3-Hexafluorpropan-2-on

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the CAS number of hexafluoroacetone?

A: CAS number of hexafluoroacetone is 684-16-2.

Q: What is the safety information for hexafluoroacetone?

A: Safety information for hexafluoroacetone: S53-S26-S28-S36-S45-S7/9.

Q: What are the downstream products of hexafluoroacetone?

A: Related downstream products(CAS) of hexafluoroacetone: 10487-11-3;66711-86-2;407-59-0;367-53-3;71040-05-6;85720-81-6;76-14-2;375-45-1;57069-95-1;31898-68-7.

Q: What is the LogP of hexafluoroacetone?

A: LogP of hexafluoroacetone is 1.89.

Q: What is the InChIKey of hexafluoroacetone?

A: InChIKey of hexafluoroacetone is VBZWSGALLODQNC-UHFFFAOYSA-N.

Q: What is the English name of hexafluoroacetone?

A: The English name of hexafluoroacetone is hexafluoroacetone.

Q: What English synonyms does hexafluoroacetone have?

A: English synonyms of hexafluoroacetone: Perfluoroacetone, 1,1,1,3,3,3-hexafluoro-2-propanone, 1,1,1,3,3,3-Hexafluoroacetone, GC 7887, 1,1,1,3,3,3-hexafluoropropan-2-one, 2-Propanone,1,1,1,3,3,3-hexafluoro, EINECS 211-676-3, tri-fluoromethyl ketone, Hexafluoroacetone, Perfluoro-2-propanone, MFCD00000422, Hexafluoro-2-propanone, Acetone,hexafluoro, 1,1,1,3,3,3-Hexafluorpropan-2-on.

Q: What is the boiling point of hexafluoroacetone?

A: Boiling point of hexafluoroacetone is -28.0±0.0 °C at 760 mmHg.

Q: What are the upstream materials of hexafluoroacetone?

A: Related upstream materials(CAS) of hexafluoroacetone: 791-50-4;428-59-1;431-35-6;383-63-1;134638-72-5;51689-98-6;161117-83-5;382-10-5;116-15-4;67-64-1.

Q: What is the molecular weight of hexafluoroacetone?

A: Molecular weight of hexafluoroacetone is 166.022.

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd

Dayang Chem (Hangzhou) Co., Ltd.

Henan Tianfu Chemical Co., Ltd.

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.

Shanghai Nianxing Industrial Co., Ltd
China
Product Name: Hexafluoroacetone
Price: Check
Purity: 97.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Hexafluoroacetone
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

Henan Tianfu Chemical Co., Ltd.
China
Product Name: Hexafluoroacetone
Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
Purity: 99.0%
Delivery: Inquiry
Contact: Anson
Email: info@tianfuchem.com

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Hexafluoroacetone

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The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.