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Perfluorohexylethyl acrylate

HCID 87149
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
17527-29-6
Standard SMILES
C=CC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
VPKQPPJQTZJZDB-UHFFFAOYSA-N
Molecular formula
C6F13CH2CH2OC(O)CH=CH2
Average molar mass
418.15 g/mol
Monoisotopic mass
418.0238456

Names & identifiers

Preferred name
Perfluorohexylethyl acrylate
IUPAC
3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl prop-2-enoate
English name
1H,1H,2H,2H-Perfluorooctyl acrylate
Molecular formula
C11H7F13O2
Molecular weight
418.15

Names & synonyms

17527-29-61h,1h,2h,2h-perfluorooctyl acrylate3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl acrylateperfluorohexylethyl acrylate2-(Perfluorohexyl)ethyl acrylate2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester1,1,2,2-Tetrahydroperfluorooctyl acrylateCHEMINOX FAAC 6ACTYFLON G 06CH8RP8R77R9EINECS 241-527-8EC 241-527-8
Show more names
TFOATEAc-61H,1H,2H,2H-PerfluorooctylPerfluorohexylAcrylateTrifluorooctyl acrylatePerfluorooctyl thacrylate2H-Perfluorooctyl acrylate
ACRYLIC ACID, 3,3,4,4,5,5,6,6,7,7,8,8,8-TRIDECAFLUOROOCTYL ESTERRefChem:860266241-527-83,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl prop-2-enoateMFCD00042351(perfluorohexyl)ethyl acrylate1H,1H,2H,2H-Tridecafluoro-n-octyl AcrylateDTXSID9038840

Database identifiers

CAS

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
15
Rotatable bonds
9
Heavy atoms
26
Formal charge
0
Complexity
535

Experimental & physicochemical properties

Chemical Classes · 2 items

Ionic Liquids

Ionic Liquids -> Fluorinated Ionic Liquids

PFAS · 6 items

PFAS -> Other/unspecified

PFAS -> PFAS identified in REACH Regulation EC No. 1272/2008

PFAS -> Fluorotelomer based substances

PFAS -> F-telomer acrylates (FTAC)

PFAS -> Intentionally added food contact chemicals

PFAS -> Other/unspecified

Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionLiquid

Physicochemical properties

Boiling point
76 · 76-80 °C8 mm Hg(lit.)
Density
1.554 g/mL · 1.554 g/mL at 25 °C(lit.)
vapor pressure
2.59 hPa · 2.59hPa at 25℃
refractive index
20 · n20/D 1.338(lit.)
Flash point
215 °F · 215 °F
storage temp.

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 8.6% (21 of 245) of reports.

Warning

H315 (17.1%): Causes skin irritation [Warning Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 245 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 5 items

Hazard Traits - Hazard Trait Undefined

2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

T - indicates a substance that is the subject of a final TSCA section 4 test rule.

REACH registered substance: 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl acrylate (EC: 241-527-8)

2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (17.1%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca

Chemistry & industry

Uses & manufacturing

U.S. Production2023: <50,000 lb
Industry UsesIntermediate
Use Classification · 2 items

PFAS (per- and polyfluoroalkyl substances) -> OECD Category

PFAS -> F-telomer acrylates (FTAC)

General Manufacturing Information · 2 items

Plastics Material and Resin Manufacturing

2-Propenoic acid, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester: ACTIVE

Applications

Uses1H,1H,2H,2H-Perfluorooctyl Acrylate is a semi-volatile fluorinated organic compound found in spring-time polluted Asian and western US air masses.

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海恩氟佳科技有限公司15800445152 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉欣扬瑞和化学科技有限公司

Related reactions

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New reaction record

No reaction records under the current filter.

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
17527-29-6
PubChem CID
87149
DTXSID
DTXSID9038840
UNII
H8RP8R77R9
EC Number
241-527-8
Nikkaji
J26.244G
2 · 2-8°C
solubility
Chloroform (Sparingly), Ethyl Acetate, Methanol (Slightly)
form
Oil
color
Colourless
Specific Gravity
1.554 · 1.554
Water Solubility
185 μg/L · 185μg/L at 25℃
Henry's Law Constant
1.9 · 1.9×10-6 mol/(m3Pa) at 25℃, Zhang et al. (2010)
Stability
Light Sensitive
InChI
1S/C11H7F13O2/c1-2-5(25)26-4-3-6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h2H,1,3-4H2
InChIKey
VPKQPPJQTZJZDB-UHFFFAOYSA-N
SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C=C
LogP
5.067 at · 5.067 at 25℃
CAS DataBase Reference
17527 · 17527-29-6(CAS DataBase Reference)
FDA UNII
8 RP8R77R9 · H8RP8R77R9
EPA Substance Registry System
1 · 1,1,2,2-Tetrahydroperfluorooctyl acrylate (17527-29-6)
UNSPSC Code
41116107 · 41116107
NACRES
23 · NA.23
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs
Liver,Teeth
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
TSCA
TSCA listed
HazardClass
IRRITANT
HS Code
29037800 · 29037800
Storage Class
10 · 10 - Combustible liquids
Hazard Classifications
1 STOT · Aquatic Chronic 1STOT RE 2
REACH Registrations
Active
TSCA listed
hs_code
29037800
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
hazard_class
IRRITANT
Storage Class
10 - Combustible liquids
target organs
Liver,Teeth
Hazard statements
H315-H319-H335
REACH Registrations
Active
Hazard Classifications
Aquatic Chronic 1STOT RE 2
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338
13720274133 · [email protected]
上海比阳实业有限公司+86-21-52699951; +8613917686115 · [email protected]
上海淖沁生物科技有限公司400-1125320 13774248860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
武汉博莱特化工有限公司+86-027-85583407 +86-13554014698 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
锦州恒通氟化学有限公司0418-2558700 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
山东穗泰生物科技有限公司15689727968 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
西氟科技有限公司0531-85906692 15588812394 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉赛沃尔化工有限公司027-85613400 18707177243 · [email protected]
上海比阳实业有限公司+86-15021878111 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
济南新润科技发展有限公司13335123100 · [email protected]
上氟科技021-65170832 15601903708 · [email protected]
江西国化医药科技有限公司0794-7183888 13155888520 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
苏州中博化工科技有限公司15250602200 · [email protected]
Yangzhou Model Electronic Materials Co., Ltd.+8613761402923 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
湖南华腾制药有限公司400-8592883 15367835770 · [email protected]
杭州宇昊化工科技有限公司0571-82693216 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
青岛瑞那斯高分子材料有限公司0532-0532-86867058 18562606086 · [email protected]
上海兴鲁化工科技有限公司02120970332 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
康迪斯化工(湖北)有限公司13343438265 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
禹城青润新材料有限公司17754345454 · [email protected]