(+/-) -Thalidomide

CAT: 0063-86297062Size: 1 gDry Ice: NoHazardous: No

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CAT#:0063-86297062Size:1 g

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CAS Number

50-35-1

Chemical Information

Thalidomide

Thalidomide can cause developmental toxicity according to an independent committee of scientific and health experts.

CAS Number	50-35-1
PubChem CID	5426
IUPAC Name	2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
Molecular Formula	C13H10N2O4
Molecular Weight	258.23
XLogP	0.3
Topological Polar Surface Area	83.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	19
Formal Charge	0
Complexity	449

SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)

InChIKey

UEJJHQNACJXSKW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 50-35-1

CID: 5426

Formula: C13H10N2O4

MW: 258.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	258.23
XLogP3	0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	258.06405680
Monoisotopic Mass	258.06405680
Topological Polar Surface Area	83.6 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	449
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