Pomalidomide Impurity B

CAT: 1299-RM-P131202-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-P131202-02Size:25 mg

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CAS Number

497147-11-2

Synonyms

2- (2,6-dioxopiperidin-3-yl) -4- (hydroxyamino) isoindoline-1,3-dione

Molecular Formula

C13H11N3O5

Molecular Weight

289.24

Target Alternative Name

Pomalidomide

Product Name Synonym

2- (2,6-dioxopiperidin-3-yl) -4- (hydroxyamino) isoindoline-1,3-dione

Chemical Information

N-Hydroxy Pomalidomide

CAS Number	497147-11-2
PubChem CID	135506537
IUPAC Name	3-(1,3-dihydroxy-4-nitrosoisoindol-2-yl)piperidine-2,6-dione
Molecular Formula	C13H11N3O5
Molecular Weight	289.24
XLogP	0.6
Topological Polar Surface Area	121
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Heavy Atom Count	21
Formal Charge	0
Complexity	471

SMILES

C1CC(=O)NC(=O)C1N2C(=C3C=CC=C(C3=C2O)N=O)O

InChI

InChI=1S/C13H11N3O5/c17-9-5-4-8(11(18)14-9)16-12(19)6-2-1-3-7(15-21)10(6)13(16)20/h1-3,8,19-20H,4-5H2,(H,14,17,18)

InChIKey

RMKXSRCTDDVULP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 497147-11-2

CID: 135506537

Formula: C13H11N3O5

MW: 289.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	289.24
XLogP3	0.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Exact Mass	289.06987046
Monoisotopic Mass	289.06987046
Topological Polar Surface Area	121 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	471
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