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Ethyl 2-((ethoxycarbonyl)oxy)propanoate

HCID 97953
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Basic information

CAS
6628-64-4
Standard SMILES
CCOC(=O)OC(C)C(=O)OCC
InChIKey
IJVJZIXXMKXYTC-UHFFFAOYSA-N
Molecular formula
C8H14O5
Average molar mass
190.19 g/mol
Monoisotopic mass
190.08412354

Names & identifiers

Preferred name
Ethyl 2-((ethoxycarbonyl)oxy)propanoate
IUPAC
ethyl 2-ethoxycarbonyloxypropanoate
English name
ethyl 2-ethoxycarbonyloxypropanoate
Molecular formula
C8H14O5
Molecular weight
190.19

Names & synonyms

DTXSID701339736ethyl 2-((ethoxycarbonyl)oxy)propanoateETHYL 2-[(ETHOXYCARBONYL)OXY]PROPANOATERefChem:1084747DTXCID6017692496628-64-4Lactic acid, ethyl carbonate, ethyl esterLactic acid, ethyl ester, ethyl carbonateNSC 60921WLN: 2VOY1&VO2Propanoic acid, 2-((ethoxycarbonyl)oxy)-, ethyl esterSCHEMBL21983314
Show more names
ethyl 2-ethoxycarbonyloxypropanoate2-[(Ethoxycarbonyl)oxy]propionic acid ethyl esterPropanoic acid, 2-[(ethoxycarbonyl)oxy]-, ethyl ester
NSC60921NSC-60921

Database identifiers

CAS
6628-64-4
PubChem CID
97953
DTXSID
DTXSID701339736
Nikkaji
J41.588J

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
13
Formal charge
0
Complexity
177

Physicochemical properties

Boiling point
112 · 112-114 °C(Press: 18 Torr)
Density
1.091 · 1.091±0.06 g/cm3(Predicted)

Related reactions

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Compound notes

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