octafluoroadiponitrile

Modify Date: 2026-07-05 16:25:50

octafluoroadiponitrile Structure
octafluoroadiponitrile structure
Common Name octafluoroadiponitrile
CAS Number 376-53-4 Molecular Weight 252.06500
Density 1.594g/cm3 Boiling Point 132.3ºC at 760mmHg
Molecular Formula C6F8N2 Melting Point N/A
MSDS N/A Flash Point 33.8ºC

 Names

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

Name 2,2,3,3,4,4,5,5-octafluorohexanedinitrile
Synonym More Synonyms

 Chemical & Physical Properties

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

Density 1.594g/cm3
Boiling Point 132.3ºC at 760mmHg
Molecular Formula C6F8N2
Molecular Weight 252.06500
Flash Point 33.8ºC
Exact Mass 251.99300
PSA 47.58000
LogP 2.57476
Index of Refraction 1.314
InChIKey PZIVXXORSILYOQ-UHFFFAOYSA-N
SMILES N#CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C#N

 Toxicological Information

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

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AV2800000
CHEMICAL NAME :
Adiponitrile, perfluoro
CAS REGISTRY NUMBER :
376-53-4
BEILSTEIN REFERENCE NO. :
1799326
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C6-F8-N2
MOLECULAR WEIGHT :
252.08
WISWESSER LINE NOTATION :
NCXFFXFFXFFXFFCN

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 :
2917 mg/kg
TOXIC EFFECTS :
Brain and Coverings - other degenerative changes Lungs, Thorax, or Respiration - other changes Kidney, Ureter, Bladder - other changes
REFERENCE :
TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. (Izdatel'stvo Meditsina, Moscow, USSR) No.1- 1961- Volume(issue)/page/year: 11,79,1969
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
62 mg/m3/4H
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Lungs, Thorax, or Respiration - other changes Kidney, Ureter, Bladder - other changes
REFERENCE :
TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. (Izdatel'stvo Meditsina, Moscow, USSR) No.1- 1961- Volume(issue)/page/year: 11,79,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1955 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - ataxia Lungs, Thorax, or Respiration - other changes
REFERENCE :
TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. (Izdatel'stvo Meditsina, Moscow, USSR) No.1- 1961- Volume(issue)/page/year: 11,79,1969
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
140 mg/m3/4H
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Lungs, Thorax, or Respiration - other changes Kidney, Ureter, Bladder - other changes
REFERENCE :
TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Substances. For English translation, see TNICS*. (Izdatel'stvo Meditsina, Moscow, USSR) No.1- 1961- Volume(issue)/page/year: 11,79,1969

 Safety Information

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

Hazard Codes T: Toxic;Xi: Irritant;
Risk Phrases R20/21/22
Safety Phrases 23-26-36/37/39
RIDADR UN 3276
HS Code 2926909090

 Synthetic Route

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

~75%

octafluoroadiponitrile Structure

octafluoroadipo...

CAS#:376-53-4

Learn More
Literature: Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , p. 173 - 175 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, , p. 190 - 192 C.A., , vol. 58, p. 10072 F: PerFHalOrg.9, 7, page 50 - 101

~%

octafluoroadiponitrile Structure

octafluoroadipo...

CAS#:376-53-4

Learn More
Literature: Khim. Prom. Ukr., , p. 24 - 26 C.A., , vol. 74, p. 52965

~%

octafluoroadiponitrile Structure

octafluoroadipo...

CAS#:376-53-4

Learn More
Literature: US3852326 , ; C.A., , vol. 82, p. 125790

 Customs

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

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

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

Octafluor-adiponitril
Octafluorohexanedinitrile
Perfluoroadipinic acid dinitrile
Adiponitrile,perfluoro
Perfluoroadipic acid dinitrile
1,4-dicyanoperfluorobutane
Perfluoroadiponitrile
Perfluoradipinsaeure-dinitril
MFCD00155894
octafluoro-adiponitrile

 octafluoroadiponitrile | FAQ

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

Q: What is the SMILES notation of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: SMILES notation of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is N#CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C#N.
Q: What is the InChIKey of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: InChIKey of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is PZIVXXORSILYOQ-UHFFFAOYSA-N.
Q: What is the polar surface area (PSA) of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: Polar surface area (PSA) of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is 47.58000.
Q: What is the CAS number of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: CAS number of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is 376-53-4.
Q: What is the English name of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: The English name of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is 2,2,3,3,4,4,5,5-octafluorohexanedinitrile.
Q: What English synonyms does 2,2,3,3,4,4,5,5-octafluorohexanedinitrile have?
A: English synonyms of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile: Octafluor-adiponitril, Octafluorohexanedinitrile, Perfluoroadipinic acid dinitrile, Adiponitrile,perfluoro, Perfluoroadipic acid dinitrile, 1,4-dicyanoperfluorobutane, Perfluoroadiponitrile, Perfluoradipinsaeure-dinitril, MFCD00155894, octafluoro-adiponitrile.
Q: What is the safety information for 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: Safety information for 2,2,3,3,4,4,5,5-octafluorohexanedinitrile: 23-26-36/37/39.
Q: What is the molecular formula of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: Molecular formula of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is C6F8N2.
Q: What is the LogP of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: LogP of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is 2.57476.
Q: What is the boiling point of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile?
A: Boiling point of 2,2,3,3,4,4,5,5-octafluorohexanedinitrile is 132.3ºC at 760mmHg.

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