CAS
93776-00-2 Purity
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93776-00-2 Purity
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(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoro-2-hydroxyundecyl)bis(2-hydroxyethyl)methylammonium iodide
CAS
93776-18-2
Catalog Number
ACM93776182
Category
Other Products
Molecular Weight
723.204284 [g/mol]
Molecular Formula
C16H19F17INO3
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Specification
Synonyms
EINECS 297-945-6, (4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoro-2-hydroxyundecyl)bis(2-hydroxyethyl)methylammonium iodide, 93776-18-2
IUPAC Name
(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-hydroxyundecyl)-bis(2-hydroxyethyl)-methylazanium iodide
Canonical SMILES
C[N+](CCO)(CCO)CC(CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O.[I-]
InChI Key
FLUXYIDFACKMRM-UHFFFAOYSA-M
Boiling Point
448.5ºC at 760mmHg
Flash Point
225.1ºC
EC Number
297-945-6
Exact Mass
723.01400
H-Bond Acceptor
21
H-Bond Donor
3
What is the molecular formula of the compound CID 21149715?
C16H19F17INO3
What is the IUPAC name of the compound CID 21149715?
(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-2-hydroxyundecyl)-bis(2-hydroxyethyl)-methylazanium;iodide
What is the molecular weight of the compound CID 21149715?
723.20 g/mol
How many hydrogen bond donor counts are there in the compound CID 21149715?
3
What is the hydrogen bond acceptor count of the compound CID 21149715?
21
What is the exact mass of the compound CID 21149715?
723.01382 g/mol
How many rotatable bond counts are present in the compound CID 21149715?
14
What is the topological polar surface area of the compound CID 21149715?
60.7 Ų
How many heavy atoms are there in the compound CID 21149715?
38
Is the compound CID 21149715 canonicalized?
Yes
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