Ethyl 5-oxopyrrolidine-3-carboxylate - CAS 60298-18-2

Catalog:	BB030640
Product Name:	Ethyl 5-oxopyrrolidine-3-carboxylate
CAS:	60298-18-2
Synonyms:	ethyl 5-oxopyrrolidine-3-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 5-oxopyrrolidine-3-carboxylate
Description:	Ethyl 5-oxopyrrolidine-3-carboxylate (CAS# 60298-18-2) is a useful research chemical compound.
Molecular Weight:	157.17
Molecular Formula:	C7H11NO3
Canonical SMILES:	CCOC(=O)C1CC(=O)NC1
InChI:	InChI=1S/C7H11NO3/c1-2-11-7(10)5-3-6(9)8-4-5/h5H,2-4H2,1H3,(H,8,9)
InChI Key:	QWMPXTNXXREMCK-UHFFFAOYSA-N
Boiling Point:	312.7 °C at 760 mmHg
Purity:	95 %
Density:	1.161 g/cm³
LogP:	0.01440

Publication Number	Title	Priority Date
WO-2021150645-A1	Novel cell metabolism modulating compounds and uses thereof	20200120
EP-3237903-A1	Methods for authentication and identification of petroleum products	20141224
EP-3237903-B1	Methods for authentication and identification of petroleum products	20141224
EP-3237904-A1	Methods for determining condition and quality of petroleum products	20141224
US-2016187314-A1	Methods for authentication and identification of petroleum products	20141224

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Pyrrolidines

[18471-41-5]
3-Amino-1-phenylpyrrolidine
[55727-59-8]
2-(Pyrrolidin-1-ylmethyl)aniline
[75847-73-3]
Enalapril
[54716-02-8]
Ethyl (E)-3-(1-pyrrolidinyl)crotonate
[5747-92-2]
Ethyl 1-benzyl-pyrrolidine-3-carboxylate
[60298-18-2]
Ethyl 5-oxopyrrolidine-3-carboxylate

Complexity:	179
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	157.07389321
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	157.07389321
Rotatable Bond Count:	3
Topological Polar Surface Area:	55.4
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.5