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3,3,4,4,5,5,5-Heptafluoro-2-pentanone

HCID 67728
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
355-17-9
Standard SMILES
CC(=O)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
XJYXROGTQYHLTH-UHFFFAOYSA-N
Molecular formula
C5H3F7O
Average molar mass
212.07 g/mol
Monoisotopic mass
212.00721185

Names & identifiers

Preferred name
3,3,4,4,5,5,5-Heptafluoro-2-pentanone
IUPAC
3,3,4,4,5,5,5-heptafluoropentan-2-one
English name
METHYL HEPTAFLUOROPROPYL KETONE
Molecular formula
C5H3F7O
Molecular weight
212.07

Names & synonyms

355-17-93,3,4,4,5,5,5-Heptafluoropentan-2-oneEV8XCB6RSQ3,3,4,4,5,5,5-Heptafluoro-2-pentanoneEINECS 206-577-72-Pentanone, 3,3,4,4,5,5,5-heptafluoro-RefChem:485111206-577-7Methyl heptafluoropropyl ketonemethyl heptafluoropropylketoneMFCD00042079UNII-EV8XCB6RSQ
Show more names
HFK-447mccMethylheptafluoropropylketone97%Methyl heptafluoropropylketone 97%1,1,1,2,2,3,3-HEPTAFLUORO-4-PENTANONEHeptafluoropropyl methyl ketone~Methyl heptafluoropropyl ketone
heptafluoropropyl methyl ketoneSCHEMBL196246SCHEMBL2333765DTXSID00188993SBB094582AKOS009157892AS-60759NS00018977

Database identifiers

CAS
355-17-9
PubChem CID
67728
DTXSID
DTXSID00188993
UNII
EV8XCB6RSQ
EC Number
206-577-7
Nikkaji
J193.839H

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
215

Experimental & physicochemical properties

PFAS · 3 items

PFAS -> Other/unspecified

PFAS -> OECD Category

PFAS -> Other/unspecified

SpringerMaterials PropertiesDielectric constant

Physicochemical properties

Boiling point
63 °C · 63 °C
Flash point
63 · 63-64°C
form
liquid
color
Clear
CAS DataBase Reference
355 · 355-17-9(CAS DataBase Reference)
FDA UNII
8 XCB6RSQ · EV8XCB6RSQ
EPA Substance Registry System
Methyl heptafluoropropylketone (355-17-9)
Symbol(GHS)
2 · GHS02,GHS07
Signal word
Danger
Hazard statements
225 · H225-H315-H319-H335
Precautionary statements

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 · 4 items

Danger

H225 (71.4%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 2 (71.4%)

Safety data

ridadr
1224
hs_code
2914199090
risk_code
36/37/38
Signal word
Danger
Symbol(GHS)
GHS02,GHS07
hazard_code
F
hazard_note
Flammable
safety_code
26-36/37/39
hazard_class
3
packing_group
II
Hazard statements
H225-H315-H319-H335
Precautionary statements
P210-P261-P303+P361+P353-P305+P351+P338-P405-P501a

Chemistry & industry

Uses & manufacturing

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

Upstream & downstream products

Upstream raw materials

ETHYL HEPTAFLUOROBUTYRYLACETATEAcetyl chlorideHeptafluorobutyric acidChlorineMETHYLMAGNESIUM IODIDE

Downstream products

4-Heptanol, 1,1,1,2,2,3,3,5,5,6,6,7,7,7-tetradecafluoro-4-methyl-

Suppliers19 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
常州新氟化学有限公司0519-85528066; 13275212658 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]

Related reactions

0 records
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
210 · P210-P261-P303+P361+P353-P305+P351+P338-P405-P501a
Hazard Codes
F
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36/37/39
RIDADR
1224 · 1224
Hazard Note
Flammable
HazardClass
3 · 3
PackingGroup
II
HS Code
2914199090 · 2914199090
武汉凯威斯科技有限公司
86-027-67849912 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
上海启乔生物科技有限公司021-37653318 15221675714 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
广东翁江化学试剂有限公司0751-2815688 13927872512 · [email protected]
中科双航化学(大连)有限公司+86-411-66858498 13941194417 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]