CAS
99114-68-8 Purity
96%
99114-68-8 Purity
96%
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Methoxycarbonylethyl-ethylsulfone
CAS
99116-15-1
Catalog Number
ACM99116151
Category
Other Products
Molecular Weight
180.222080 [g/mol]
Molecular Formula
C6H12O4S
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Specification
Synonyms
METHOXYCARBONYLETHYL-ETHYLSULFONE, 99116-15-1, CTK5I0237, AKOS009478270, AG-I-00976
IUPAC Name
methyl 3-ethylsulfonylpropanoate
Canonical SMILES
CCS(=O)(=O)CCC(=O)OC
InChI Key
OJKZXEQOEZBJOE-UHFFFAOYSA-N
Exact Mass
180.04600
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Methoxycarbonylethyl-ethylsulfone?
The molecular formula of Methoxycarbonylethyl-ethylsulfone is C6H12O4S.
When was Methoxycarbonylethyl-ethylsulfone created in PubChem?
Methoxycarbonylethyl-ethylsulfone was created in PubChem on December 4, 2007.
What is the IUPAC name of Methoxycarbonylethyl-ethylsulfone?
The IUPAC name of Methoxycarbonylethyl-ethylsulfone is methyl 3-ethylsulfonylpropanoate.
What is the molecular weight of Methoxycarbonylethyl-ethylsulfone?
The molecular weight of Methoxycarbonylethyl-ethylsulfone is 180.22 g/mol.
What is the InChIKey of Methoxycarbonylethyl-ethylsulfone?
The InChIKey of Methoxycarbonylethyl-ethylsulfone is OJKZXEQOEZBJOE-UHFFFAOYSA-N.
How many hydrogen bond acceptors does Methoxycarbonylethyl-ethylsulfone have?
Methoxycarbonylethyl-ethylsulfone has 4 hydrogen bond acceptors.
What is the topological polar surface area of Methoxycarbonylethyl-ethylsulfone?
The topological polar surface area of Methoxycarbonylethyl-ethylsulfone is 68.8 Ų.
Does Methoxycarbonylethyl-ethylsulfone have any defined atom stereocenters?
No, Methoxycarbonylethyl-ethylsulfone does not have any defined atom stereocenters.
How many rotatable bond counts does Methoxycarbonylethyl-ethylsulfone have?
Methoxycarbonylethyl-ethylsulfone has 5 rotatable bond counts.
Is Methoxycarbonylethyl-ethylsulfone a canonicalized compound in PubChem?
Yes, Methoxycarbonylethyl-ethylsulfone is a canonicalized compound in PubChem.
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