CAS
898793-71-0 Purity
96%
898793-71-0 Purity
96%
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Ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate
CAS
898793-74-3
Catalog Number
ACM898793743
Category
Other Products
Molecular Weight
303.4
Molecular Formula
C18H25NO3
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Specification
Synonyms
ETHYL 4-OXO-4-[3-(PIPERIDINOMETHYL)PHENYL]BUTYRATE
IUPAC Name
ethyl 4-oxo-4-[3-(piperidin-1-ylmethyl)phenyl]butanoate
Canonical SMILES
CCOC(=O)CCC(=O)C1=CC(=CC=C1)CN2CCCCC2
InChI Key
ZOMZOJVHFGXLCQ-UHFFFAOYSA-N
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The molecular formula of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is C18H25NO3.
What is the molecular weight of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The molecular weight of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is 303.4 g/mol.
What is the IUPAC name of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The IUPAC name of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is ethyl 4-oxo-4-[3-(piperidin-1-ylmethyl)phenyl]butanoate.
What is the InChIKey of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The InChIKey of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is ZOMZOJVHFGXLCQ-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts does ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate have?
Ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate has 4 hydrogen bond acceptor counts.
What is the XLogP3-AA value of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The XLogP3-AA value of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is 2.4.
Does ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate have any defined atom stereocenter count?
No, ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate does not have any defined atom stereocenter count.
What is the topological polar surface area of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The topological polar surface area of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is 46.6 Ų.
Is ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate a canonicalized compound?
Yes, ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is a canonicalized compound.
What is the exact mass of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate?
The exact mass of ethyl 4-oxo-4-[3-(piperidinomethyl)phenyl]butyrate is 303.18344366 g/mol.
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