CAS
94108-58-4 Purity
96%
94108-58-4 Purity
96%
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1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride
CAS
94108-66-4
Catalog Number
ACM94108664
Category
Other Products
Molecular Weight
535.287360 [g/mol]
Molecular Formula
C33H59ClN2O
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Specification
Synonyms
EINECS 302-406-6, 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazoliumchloride, 94108-66-4
IUPAC Name
2-(1-benzyl-2-henicosyl-4,5-dihydroimidazol-1-ium-1-yl)ethanol chloride
SMILES
CCCCCCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]
InChI Key
YVEGUVHIATZFPU-UHFFFAOYSA-M
EC Number
302-406-6
Exact Mass
534.43200
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
The molecular formula is C33H60ClN2O+.
What is the molecular weight of 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
The molecular weight is 536.3 g/mol.
When was 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride created?
It was created on February 16, 2015.
What are some synonyms for 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
One synonym is "1-BENZYL-2-HENICOSYL-4,5-DIHYDRO-1-(2-HYDROXYETHYL)-1H-IMIDAZOLIUM CHLORIDE".
What is the IUPAC name of 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
The IUPAC name is 2-(1-benzyl-2-henicosyl-4,5-dihydroimidazole-1,3-diium-1-yl)ethanol;chloride.
What is the Canonical SMILES representation of 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
The Canonical SMILES representation is CCCCCCCCCCCCCCCCCCCCCC1=[NH+]CC[N+]1(CCO)CC2=CC=CC=C2.[Cl-].
What is the InChIKey of 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
The InChIKey is YVEGUVHIATZFPU-UHFFFAOYSA-N.
What is the exact mass of 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride?
The exact mass is 535.4394172 g/mol.
How many hydrogen bond donor counts does 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride have?
It has 2 hydrogen bond donor counts.
Is 1-Benzyl-2-henicosyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium chloride considered the canonicalized compound?
Yes, it is considered canonicalized.
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