Methsuximide

CAT: 1596-AR-M04494-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-M04494-02Size:25 Units

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CAS Number

77-41-8

Synonyms

1,3-dimethyl-3-phenylpyrrolidine-2,5-dione

Molecular Formula

C12H13NO2

Molecular Weight

203.24

API Name

Methsuximide

Chemical Information

Methsuximide

Methsuximide is an organic molecular entity.

CAS Number	77-41-8
PubChem CID	6476
IUPAC Name	1,3-dimethyl-3-phenylpyrrolidine-2,5-dione
Molecular Formula	C12H13NO2
Molecular Weight	203.24
XLogP	1.2
Topological Polar Surface Area	37.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	15
Formal Charge	0
Complexity	294

SMILES

CC1(CC(=O)N(C1=O)C)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO2/c1-12(9-6-4-3-5-7-9)8-10(14)13(2)11(12)15/h3-7H,8H2,1-2H3

InChIKey

AJXPJJZHWIXJCJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 77-41-8

CID: 6476

Formula: C12H13NO2

MW: 203.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	203.24
XLogP3	1.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	203.094628657
Monoisotopic Mass	203.094628657
Topological Polar Surface Area	37.4 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	294
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