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5-Oxoproline ethyl ester

5-Oxoproline ethyl ester structure

CAS No:
66183-71-9
Formula:
C7H11NO3
Chemical Name:
5-Oxoproline ethyl ester
Synonyms:
Proline,5-oxo-,ethyl ester;Pyroglutamic acid,ethyl ester,DL-;DL-Proline,5-oxo-,ethyl ester;5-Oxoproline ethyl ester;5-Oxopyrrolidine-2-carboxylic acid ethyl ester;Ethyl 5-oxopyrrolidine-2-carboxylate
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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5-Oxoproline ethyl ester Basic Attributes

Molecular Weight：

157.16714

Exact Mass：

157.17

EC Number：

266-226-9

NSC Number：

166529|72279

HScode：

2933790090

Characteristics

PSA：

55.4

XLogP3：

-1.39

Density：

1.2±0.1 g/cm3

Melting Point：

54 °C

Boiling Point：

137-140 °C @ Press: 0.45 Torr

Flash Point：

142.9±25.9 °C

Refractive Index：

1.466

Computed Properties

Molecular Weight:157.17
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:157.07389321
Monoisotopic Mass:157.07389321
Topological Polar Surface Area:55.4
Heavy Atom Count:11
Complexity:179
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes