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65294-16-8

65294-16-8 structural image
Product Name: PERFLUORO(2,5,8-TRIMETHYL-3,6,9-TRIOXADECANOIC) ACID
Formula: C12HF23O5
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 278.77 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Dataset: PFAS]
Chemical Classes PFAS

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H314:Skin corrosion/irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 662.10 g/mol
XLogP3 7.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 28
Rotatable Bond Count 10
Exact Mass 661.9456709 g/mol
Monoisotopic Mass 661.9456709 g/mol
Topological Polar Surface Area 65 Ų
Heavy Atom Count 40
Formal Charge 0
Complexity 931
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes