Structure

Ethyl pyruvate

CAS
617-35-6
Catalog Number
ACM617356
Category
Other Products
Molecular Weight
116.12
Molecular Formula
C5H8O3

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Specification

Description
ethyl pyruvate (EP) has demonstrated neuroprotective effects against acute brain injury through its anti-inflammatory action.
Synonyms
2-Oxopropionic acid ethyl
IUPAC Name
Ethyl 2-oxopropanoate
Canonical SMILES
CCOC(=O)C(=O)C
InChI
InChI=1S/C5H8O3/c1-3-8-5(7)4(2)6/h3H2,1-2H3
InChI Key
XXRCUYVCPSWGCC-UHFFFAOYSA-N
Boiling Point
144 °C(lit.)
Melting Point
-58 °C
Flash Point
114 °F
Density
1.045 g/mL at 25 °C(lit.)
Solubility
Miscible with water, ethanol and ether
Appearance
Clear pale yellow liquid
Storage
2-8 °C
Active Content
95%
Complexity
106
EC Number
210-511-2
Exact Mass
116.047344113
Hazard Codes
Xi; F
Hazard Statements
Xi,F
HS Code
2918300090
LogP
0.13850
MDL Number
MFCD00009123
Monoisotopic Mass
116.047344113
Physical State
Liquid
PSA
43.37
Refractive Index
n20/D 1.404(lit.)
RIDADR
UN 3272 3/PG 3
Safety Description
16
Stability
Stable under normal temperatures and pressures.
Storage Conditions
Dry place
Supplemental Hazard Statements
H226
Symbol
GHS02
Topological Polar Surface Area
43.4 Ų
WGK Germany
3
What is the molecular formula of ethyl pyruvate?

The molecular formula of ethyl pyruvate is C5H8O3.

What is the molecular weight of ethyl pyruvate?

The molecular weight of ethyl pyruvate is 116.11 g/mol.

What is the IUPAC name of ethyl pyruvate?

The IUPAC name of ethyl pyruvate is ethyl 2-oxopropanoate.

What is the CAS number of ethyl pyruvate?

The CAS number of ethyl pyruvate is 617-35-6.

What is the InChIKey of ethyl pyruvate?

The InChIKey of ethyl pyruvate is XXRCUYVCPSWGCC-UHFFFAOYSA-N.

What is the XLogP3-AA value of ethyl pyruvate?

The XLogP3-AA value of ethyl pyruvate is 0.4.

How many hydrogen bond acceptors are there in the structure of ethyl pyruvate?

There are 3 hydrogen bond acceptors in the structure of ethyl pyruvate.

What is the exact mass of ethyl pyruvate?

The exact mass of ethyl pyruvate is 116.047344113 g/mol.

What is the topological polar surface area of ethyl pyruvate?

The topological polar surface area of ethyl pyruvate is 43.4 Ų.

What is the Heavy Atom Count of ethyl pyruvate?

The Heavy Atom Count of ethyl pyruvate is 8.

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