Dimethachlon Impurity 7

CAT: 1596-AR-D07126-04Size: 100 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-D07126-04Size:100 Units

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CAS Number

20400-73-1

Synonyms

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

Molecular Formula

C10H9NO3

Molecular Weight

191.19

API Name

Dimethachlon

Chemical Information

2-hydroxy-N-phenylsuccinimide

structure given in first source

CAS Number	20400-73-1
PubChem CID	14435728
IUPAC Name	3-hydroxy-1-phenylpyrrolidine-2,5-dione
Molecular Formula	C10H9NO3
Molecular Weight	191.18
XLogP	-0.3
Topological Polar Surface Area	57.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	258

SMILES

C1C(C(=O)N(C1=O)C2=CC=CC=C2)O

InChI

InChI=1S/C10H9NO3/c12-8-6-9(13)11(10(8)14)7-4-2-1-3-5-7/h1-5,8,12H,6H2

InChIKey

QNDRHEMEDHNOMU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20400-73-1

CID: 14435728

Formula: C10H9NO3

MW: 191.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	191.18
XLogP3	-0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	191.058243149
Monoisotopic Mass	191.058243149
Topological Polar Surface Area	57.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	258
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

Catalog	Name
AR-D07119-01	Dimethachlon Impurity 3
AR-D07127-01	Dimethachlon Impurity 8
AR-D07124-01	Dimethachlon Impurity 2
AR-D07123-01	Dimethachlon Impurity 1
AR-D07122-01	Dimethachlon
AR-D07125-01	Dimethachlon Impurity 4 Disodium Salt
AR-D07121-01	Dimethachlon Impurity 6 Sodium Salt
AR-D07120-01	Dimethachlon Impurity 5 Disodium Salt
AR-N01603-01	Nintedanib Impurity 7 (Intedanib Impurity 7)
AR-L01591-01	Levosimendan Impurity 7

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