CAS
93963-00-9 Purity
96%
93963-00-9 Purity
96%
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Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate
CAS
93963-07-6
Catalog Number
ACM93963076
Category
Other Products
Molecular Weight
432.615470 [g/mol]
Molecular Formula
C24H46N2O3Na
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Specification
Synonyms
EINECS 300-747-5, CID3023076, Sodium (2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy)acetate, 93963-07-6
IUPAC Name
sodium 2-[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethoxy]acetate
SMILES
CCCCCCCCCCCCCCCCCC1=NCCN1CCOCC(=O)[O-].[Na+]
InChI Key
UXJVKMLQYNRISL-UHFFFAOYSA-M
Boiling Point
568.6ºC at 760mmHg
Flash Point
297.7ºC
EC Number
300-747-5
Exact Mass
432.33300
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
The molecular formula is C24H45N2NaO3.
When was Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate created and last modified?
It was created on 2008-02-05 and last modified on 2023-12-30.
What is the IUPAC name of Sodium[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethoxy]acetate?
The IUPAC name is sodium;2-[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethoxy]acetate.
What is the Canonical SMILES of Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
The Canonical SMILES is CCCCCCCCCCCCCCCCC1=NCCN1CCOCC(=O)[O-].[Na+].
What is the molecular weight of Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
The molecular weight is 432.6 g/mol.
How many hydrogen bond donor counts are there in Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
There are 0 hydrogen bond donor counts.
What is the hydrogen bond acceptor count of Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
The hydrogen bond acceptor count is 4.
What is the topological polar surface area of Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
The topological polar surface area is 65 Ǻ².
How many rotatable bond counts are there in Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate?
There are 21 rotatable bond counts.
Is Sodium[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethoxy]acetate considered canonicalized?
Yes, the compound is canonicalized.
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