CAS
898792-47-7 Purity
96%
898792-47-7 Purity
96%
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Ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate
CAS
898792-50-2
Catalog Number
ACM898792502
Category
Other Products
Molecular Weight
347.45
Molecular Formula
C20H29NO4
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Specification
Synonyms
ETHYL 7-[3-(MORPHOLINOMETHYL)PHENYL]-7-OXOHEPTANOATE
IUPAC Name
ethyl 7-[3-(morpholin-4-ylmethyl)phenyl]-7-oxoheptanoate
SMILES
CCOC(=O)CCCCCC(=O)C1=CC(=CC=C1)CN2CCOCC2
InChI Key
CRESNUNBHUWNJA-UHFFFAOYSA-N
Boiling Point
473.2ºC at 760 mmHg
Flash Point
240ºC
Density
1.094g/cm³
Exact Mass
347.21000
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
The molecular formula of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is C20H29NO4.
What is the molecular weight of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
The molecular weight of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is 347.4 g/mol.
When was ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate created and last modified?
Ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate was created on 2008-02-29 and last modified on 2023-12-30.
What is the IUPAC name of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
The IUPAC name of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is ethyl 7-[3-(morpholin-4-ylmethyl)phenyl]-7-oxoheptanoate.
What is the Canonical SMILES representation of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
The Canonical SMILES representation of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is CCOC(=O)CCCCCC(=O)C1=CC=CC(=C1)CN2CCOCC2.
What is the InChIKey of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
The InChIKey of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is CRESNUNBHUWNJA-UHFFFAOYSA-N.
How many hydrogen bond acceptors are present in ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
There are 5 hydrogen bond acceptors in ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate.
What is the topological polar surface area of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
The topological polar surface area of ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is 55.8 Ų.
How many rotatable bonds are present in ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate?
There are 11 rotatable bonds in ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate.
Is ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate the canonicalized compound?
Yes, ethyl 7-[3-(morpholinomethyl)phenyl]-7-oxoheptanoate is the canonicalized compound.
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