CAS
96507-89-0 Purity
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96507-89-0 Purity
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AMONIUM PERFLUORO(2-METHYL-3-OXAOCTADECANOATE)
CAS
96513-97-2
Catalog Number
ACM96513972
Category
Other Products
Molecular Weight
447.09
Molecular Formula
C8HF15O3.H3N
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Specification
Synonyms
AMONIUM PERFLUORO(2-METHYL-3-OXAOCTADECANOATE);2,3,3,3-Tetrafluoro-2-(nonafluorobutoxy)-propanoicaciammoniumsalt;AMONIUM PERFLUORO(2-METHYL-3-OXAOOCTANOATE)
IUPAC Name
azanylium;2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentoxy)propanoate
Canonical SMILES
C(=O)(C(C(F)(F)F)(OC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F)[O-].[NH2+]
InChI Key
WJSNTTOFDRWDTO-UHFFFAOYSA-M
Exact Mass
396.99800
H-Bond Acceptor
19
H-Bond Donor
1
What is the molecular formula of AMONIUM PERFLUORO(2-METHYL-3-OXAOCTADECANOATE)?
The molecular formula is C8H4F15NO3.
When was this compound created and last modified?
It was created on 2016-11-23 and last modified on 2023-12-30.
What is the IUPAC name of AMONIUM PERFLUORO(2-METHYL-3-OXAOCTADECANOATE)?
The IUPAC name is azane; 2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentoxy)propanoic acid.
What is the InChIKey of the compound?
The InChIKey is HZVUWLKXQRJTAL-UHFFFAOYSA-N.
What is the molecular weight of AMONIUM PERFLUORO(2-METHYL-3-OXAOCTADECANOATE)?
The molecular weight is 447.10 g/mol.
How many hydrogen bond donor counts does the compound have?
It has 2 hydrogen bond donor counts.
What is the heavy atom count of AMONIUM PERFLUORO(2-METHYL-3-OXAOCTADECANOATE)?
The heavy atom count is 27.
Is the compound canonicalized?
Yes, the compound is canonicalized.
How many hydrogen bond acceptor counts does it have?
It has 19 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 47.5 Å2.
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