CAS
913844-45-8 Purity
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913844-45-8 Purity
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Propanoicacid,2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]-,ethyl ester
CAS
913849-17-9
Catalog Number
ACM913849179
Category
Other Products
Molecular Weight
277.239670 [g/mol]
Molecular Formula
C12H14F3NO3
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Specification
Synonyms
Ethyl 2-methyl-2-[[5-(trifluoromethyl)pyridin-2-yl]oxy]propanoate;Propanoic acid, 2-methyl-2-[[5-(trifluoromethyl)-2-pyridinyl]oxy]-, ethyl ester
IUPAC Name
ethyl 2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]oxypropanoate
InChI Key
YPJQHNRUYWGMGQ-UHFFFAOYSA-N
Boiling Point
291.6ºC at 760 mmHg
Flash Point
130.2ºC
Density
1.225g/cm³
Exact Mass
277.09300
H-Bond Acceptor
7
H-Bond Donor
0
What is the IUPAC name of the compound with PubChem CID 16098340?
The IUPAC name is ethyl 2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]oxypropanoate.
What is the molecular formula of the compound?
The molecular formula is C12H14F3NO3.
What is the molecular weight of the compound?
The molecular weight is 277.24 g/mol.
What is the Canonical SMILES representation of the compound?
CCOC(=O)C(C)(C)OC1=NC=C(C=C1)C(F)(F)F
What is the InChIKey of the compound?
YPJQHNRUYWGMGQ-UHFFFAOYSA-N
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 2.9.
What is the exact mass of the compound?
The exact mass is 277.09257779 g/mol.
How many hydrogen bond acceptor counts does the compound have?
The compound has 7 hydrogen bond acceptor counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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