CAS
93777-50-5 Purity
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93777-50-5 Purity
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![N-[2-(Diethylamino)ethyl]phenyl(3,4,5-trimethoxyphenyl)methylene]acetamide monohydrochloride](https://resource.alfa-chemistry.com/structure/93777-59-4.gif)
![N-[2-(Diethylamino)ethyl]-3,4-dimethoxy-alpha-[(3,4,5-trimethoxyphenyl)methylene]phenylacetamide monohydrochloride](https://resource.alfa-chemistry.com/structure/93777-60-7.gif)
![2-[1-(4-Nitrophenyl)-2-(2,4,5-trimethoxyphenyl)vinyl]-(5H)-oxazole-4,4-dimethanol hydrochloride](https://resource.alfa-chemistry.com/structure/93777-61-8.gif)
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2-[1-Phenyl-2-(2,4,5-trimethoxyphenyl)vinyl]-2-oxazoline-4,4-dimethanol hydrochloride
CAS
93777-58-3
Catalog Number
ACM93777583
Category
Other Products
Molecular Weight
435.897940 [g/mol]
Molecular Formula
C22H25NO6.HCl
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Specification
Synonyms
EINECS 298-090-1, 2-(1-Phenyl-2-(2,4,5-trimethoxyphenyl)vinyl)-2-oxazoline-4,4-dimethanol hydrochloride, 93777-58-3
IUPAC Name
[4-(hydroxymethyl)-2-[(Z)-1-phenyl-2-(2,4,5-trimethoxyphenyl)ethenyl]-5H-1,3-oxazol-4-yl]methanol hydrochloride
Canonical SMILES
COC1=CC(=C(C=C1C=C(C2=CC=CC=C2)C3=NC(CO3)(CO)CO)OC)OC.Cl
InChI Key
JWFYNHPJLQDORK-WPTDRQDKSA-N
Boiling Point
588.2ºC at 760mmHg
Flash Point
309.5ºC
EC Number
298-090-1
Exact Mass
435.14500
H-Bond Acceptor
7
H-Bond Donor
3
What is the molecular formula of the compound?
The molecular formula of the compound is C22H26ClNO6.
What are the synonyms of the compound?
The synonyms of the compound include EINECS 298-090-1 and 2-[1-Phenyl-2-(2,4,5-trimethoxyphenyl)vinyl]-2-oxazoline-4,4-dimethanol hydrochloride.
What is the molecular weight of the compound?
The molecular weight of the compound is 435.9 g/mol.
What is the parent compound of the given compound?
The parent compound is CID 44151310, which is [4-(hydroxymethyl)-2-[(Z)-1-phenyl-2-(2,4,5-trimethoxyphenyl)ethenyl]-5H-1,3-oxazol-4-yl]methanol.
When was the compound created and last modified?
The compound was created on 2009-08-20 and last modified on 2023-12-30.
What is the IUPAC name of the compound?
The IUPAC name of the compound is [4-(hydroxymethyl)-2-[(Z)-1-phenyl-2-(2,4,5-trimethoxyphenyl)ethenyl]-5H-1,3-oxazol-4-yl]methanol;hydrochloride.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is COC1=CC(=C(C=C1C=C(C2=CC=CC=C2)C3=NC(CO3)(CO)CO)OC)OC.Cl.
What is the InChIKey of the compound?
The InChIKey of the compound is JWFYNHPJLQDORK-WPTDRQDKSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 3 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 7 hydrogen bond acceptor counts.
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