65294-16-8
Product Name:
PERFLUORO(2,5,8-TRIMETHYL-3,6,9-TRIOXADECANOIC) ACID
Formula:
C12HF23O5
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 278.77 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Dataset: PFAS] |
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Chemical Classes | PFAS |
SAFETY INFORMATION
Signal word | Danger |
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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 |
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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 |