Glycopyrrolate Impurity 34

CAT: 1299-RM-G122534-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-G122534-01Size:10 mg

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CAS Number

222856-39-5

Synonyms

4-hydroxy-1-methylpyrrolidin-2-one

Molecular Formula

C5H9NO2

Molecular Weight

115.13

Target Alternative Name

Glycopyrrolate

Product Name Synonym

4-hydroxy-1-methylpyrrolidin-2-one

Chemical Information

4-Hydroxy-1-methylpyrrolidin-2-one

CAS Number	222856-39-5
PubChem CID	17811779
IUPAC Name	4-hydroxy-1-methylpyrrolidin-2-one
Molecular Formula	C5H9NO2
Molecular Weight	115.13
XLogP	-1.2
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	113

SMILES

CN1CC(CC1=O)O

InChI

InChI=1S/C5H9NO2/c1-6-3-4(7)2-5(6)8/h4,7H,2-3H2,1H3

InChIKey

YRVPVSMWSPGZSV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 222856-39-5

CID: 17811779

Formula: C5H9NO2

MW: 115.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	115.13
XLogP3	-1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	115.063328530
Monoisotopic Mass	115.063328530
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	113
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes